Showing NP-Card for 13-Cyclopentyl-13-desmethyl-erythromycin (NP0023921)
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Version | 2.0 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Created at | 2021-01-06 08:56:46 UTC | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Updated at | 2021-07-15 17:43:03 UTC | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
NP-MRD ID | NP0023921 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Secondary Accession Numbers | None | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Natural Product Identification | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Common Name | 13-Cyclopentyl-13-desmethyl-erythromycin | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Provided By | NPAtlas![]() | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Description | 13-Cyclopentyl-13-desmethyl-erythromycin is found in Saccharopolyspora erythraea. Based on a literature review very few articles have been published on (3R,4S,5S,6R,7R,9R,11R,12S,13R,14R)-14-cyclopentyl-6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-7,12-dihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione. | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Structure | MOL for NP0023921 (13-Cyclopentyl-13-desmethyl-erythromycin)Mrv1652307042108223D 124127 0 0 0 0 999 V2000 2.3002 7.4281 0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 6.0836 0.5401 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9923 5.5423 0.2471 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7904 5.7041 -1.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0798 4.0403 0.5461 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2723 3.3881 0.4332 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3860 2.2002 1.0878 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.1007 0.2676 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4546 0.1081 0.4554 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0119 0.3396 1.8489 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5722 0.0844 -0.4996 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5235 -0.8484 -0.0995 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7337 -0.4205 0.2492 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9590 -0.7387 1.5879 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8833 -2.0742 1.8464 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3589 -2.2633 3.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5859 -2.9992 0.9320 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0874 -2.4457 -0.3489 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4771 -2.8498 -0.6219 N 0 0 2 0 0 0 0 0 0 0 0 0 6.8410 -2.2127 -1.8806 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5079 -4.2794 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9406 -0.9597 -0.4794 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0498 -0.4146 0.2264 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3033 -0.2769 -1.9107 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5358 0.0194 -2.7461 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2779 0.4098 -2.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0813 -1.7906 -2.0652 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4056 -2.0866 -2.1961 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7228 -2.2136 -3.6637 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6539 -3.4028 -1.5463 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -4.3440 -1.9474 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6827 -3.5799 -0.4534 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4445 -4.9739 0.1371 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0685 -3.4164 -0.9703 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4526 -4.6130 -1.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0775 -2.9005 0.0062 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6689 -3.0949 1.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5285 -1.5114 -0.3478 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4585 -0.9610 0.6870 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9654 0.4084 0.3814 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2549 0.4616 1.2143 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.7498 -0.9428 1.3022 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.7553 -1.7779 0.5735 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4680 -0.7479 -0.7411 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9143 0.4293 -0.4704 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 1.4538 -1.1715 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0122 0.5933 0.7027 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6499 1.4863 1.7478 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3169 4.2018 0.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9871 5.1990 1.6809 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3889 4.7630 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0929 6.2100 1.0032 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9128 6.9551 0.1434 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5547 8.0627 0.7011 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2945 7.8640 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1356 7.5826 -0.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7064 5.5245 -1.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0307 4.9965 -1.5211 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3921 6.7130 -1.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7568 3.6534 -0.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 3.8760 1.5045 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4202 3.1879 -0.6698 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6806 1.5324 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.9015 0.4859 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3266 -0.5556 2.3648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8927 1.0416 1.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2396 0.8189 2.5214 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0766 1.0736 -0.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8301 0.7093 0.2099 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7905 -2.3593 1.8916 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1237 -1.4830 3.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5304 -2.1510 4.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8107 -3.2735 3.3616 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4795 -3.4117 1.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -3.9167 0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4961 -2.9050 -1.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9246 -2.1566 -2.5105 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 -1.1901 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5646 -2.8487 -2.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5207 -4.5296 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4192 -4.8733 0.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7779 -4.5461 -1.6385 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0733 -0.6039 -1.4981 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2662 -0.9978 1.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1444 0.7521 -2.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2777 0.3825 -3.7669 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1433 -0.8923 -2.8656 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6095 1.2822 -2.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6716 -2.2288 -2.8626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4119 -2.2417 -1.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -1.2657 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -2.4571 -3.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5209 -1.2444 -4.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0663 -3.0100 -4.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4538 -2.7967 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5534 -5.4630 -0.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -5.6482 -0.0454 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2019 -4.8818 1.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -2.6725 -1.8189 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4155 -4.7680 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9812 -3.5798 -0.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8169 -2.5188 1.7772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4993 -4.2072 1.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5448 -2.9019 2.1107 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1762 -1.6494 -1.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0599 -0.9718 1.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1936 0.5668 -0.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3473 1.2372 0.7761 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0318 0.8175 2.2502 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9764 1.1809 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8710 -1.3227 2.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7564 -1.0146 0.8217 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6339 -2.7998 0.9395 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0182 -1.7444 -0.5212 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8933 -0.3978 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2467 2.3018 1.2707 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8336 1.9652 2.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2967 0.9100 2.4435 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 5.7451 1.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5817 5.2914 3.1556 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 5.0556 3.8667 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2056 3.6955 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2726 6.9244 1.7926 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7364 7.1676 0.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 3 2 1 1 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 18 22 1 0 0 0 0 22 23 1 0 0 0 0 11 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 6 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 38 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 2 0 0 0 0 45 47 1 0 0 0 0 47 48 1 0 0 0 0 6 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 52 53 1 0 0 0 0 52 3 1 0 0 0 0 47 8 1 0 0 0 0 22 13 1 0 0 0 0 43 39 1 0 0 0 0 1 54 1 0 0 0 0 1 55 1 0 0 0 0 1 56 1 0 0 0 0 4 57 1 0 0 0 0 4 58 1 0 0 0 0 4 59 1 0 0 0 0 5 60 1 0 0 0 0 5 61 1 0 0 0 0 6 62 1 6 0 0 0 8 63 1 6 0 0 0 9 64 1 1 0 0 0 10 65 1 0 0 0 0 10 66 1 0 0 0 0 10 67 1 0 0 0 0 11 68 1 6 0 0 0 13 69 1 1 0 0 0 15 70 1 1 0 0 0 16 71 1 0 0 0 0 16 72 1 0 0 0 0 16 73 1 0 0 0 0 17 74 1 0 0 0 0 17 75 1 0 0 0 0 18 76 1 6 0 0 0 20 77 1 0 0 0 0 20 78 1 0 0 0 0 20 79 1 0 0 0 0 21 80 1 0 0 0 0 21 81 1 0 0 0 0 21 82 1 0 0 0 0 22 83 1 6 0 0 0 23 84 1 0 0 0 0 25 85 1 0 0 0 0 25 86 1 0 0 0 0 25 87 1 0 0 0 0 26 88 1 0 0 0 0 27 89 1 0 0 0 0 27 90 1 0 0 0 0 28 91 1 1 0 0 0 29 92 1 0 0 0 0 29 93 1 0 0 0 0 29 94 1 0 0 0 0 32 95 1 1 0 0 0 33 96 1 0 0 0 0 33 97 1 0 0 0 0 33 98 1 0 0 0 0 34 99 1 6 0 0 0 35100 1 0 0 0 0 36101 1 1 0 0 0 37102 1 0 0 0 0 37103 1 0 0 0 0 37104 1 0 0 0 0 38105 1 6 0 0 0 39106 1 1 0 0 0 40107 1 0 0 0 0 40108 1 0 0 0 0 41109 1 0 0 0 0 41110 1 0 0 0 0 42111 1 0 0 0 0 42112 1 0 0 0 0 43113 1 0 0 0 0 43114 1 0 0 0 0 47115 1 1 0 0 0 48116 1 0 0 0 0 48117 1 0 0 0 0 48118 1 0 0 0 0 50119 1 1 0 0 0 51120 1 0 0 0 0 51121 1 0 0 0 0 51122 1 0 0 0 0 52123 1 1 0 0 0 53124 1 0 0 0 0 M END 3D MOL for NP0023921 (13-Cyclopentyl-13-desmethyl-erythromycin)RDKit 3D 124127 0 0 0 0 0 0 0 0999 V2000 2.3002 7.4281 0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 6.0836 0.5401 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9923 5.5423 0.2471 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7904 5.7041 -1.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0798 4.0403 0.5461 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2723 3.3881 0.4332 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3860 2.2002 1.0878 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.1007 0.2676 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4546 0.1081 0.4554 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0119 0.3396 1.8489 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5722 0.0844 -0.4996 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5235 -0.8484 -0.0995 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7337 -0.4205 0.2492 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9590 -0.7387 1.5879 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8833 -2.0742 1.8464 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3589 -2.2633 3.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5859 -2.9992 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 -2.4457 -0.3489 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4771 -2.8498 -0.6219 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -2.2127 -1.8806 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5079 -4.2794 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9406 -0.9597 -0.4794 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0498 -0.4146 0.2264 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3033 -0.2769 -1.9107 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5358 0.0194 -2.7461 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2779 0.4098 -2.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0813 -1.7906 -2.0652 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4056 -2.0866 -2.1961 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7228 -2.2136 -3.6637 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6539 -3.4028 -1.5463 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -4.3440 -1.9474 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6827 -3.5799 -0.4534 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4445 -4.9739 0.1371 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0685 -3.4164 -0.9703 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4526 -4.6130 -1.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0775 -2.9005 0.0062 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6689 -3.0949 1.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5285 -1.5114 -0.3478 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4585 -0.9610 0.6870 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9654 0.4084 0.3814 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2549 0.4616 1.2143 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7498 -0.9428 1.3022 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7553 -1.7779 0.5735 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 -0.7479 -0.7411 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9143 0.4293 -0.4704 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 1.4538 -1.1715 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0122 0.5933 0.7027 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6499 1.4863 1.7478 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3169 4.2018 0.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9871 5.1990 1.6809 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3889 4.7630 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0929 6.2100 1.0032 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9128 6.9551 0.1434 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5547 8.0627 0.7011 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2945 7.8640 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1356 7.5826 -0.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7064 5.5245 -1.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0307 4.9965 -1.5211 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3921 6.7130 -1.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7568 3.6534 -0.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 3.8760 1.5045 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4202 3.1879 -0.6698 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6806 1.5324 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.9015 0.4859 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3266 -0.5556 2.3648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8927 1.0416 1.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2396 0.8189 2.5214 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0766 1.0736 -0.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8301 0.7093 0.2099 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7905 -2.3593 1.8916 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1237 -1.4830 3.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5304 -2.1510 4.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8107 -3.2735 3.3616 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4795 -3.4117 1.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -3.9167 0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4961 -2.9050 -1.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9246 -2.1566 -2.5105 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 -1.1901 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5646 -2.8487 -2.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5207 -4.5296 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4192 -4.8733 0.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7779 -4.5461 -1.6385 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0733 -0.6039 -1.4981 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2662 -0.9978 1.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1444 0.7521 -2.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2777 0.3825 -3.7669 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1433 -0.8923 -2.8656 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6095 1.2822 -2.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6716 -2.2288 -2.8626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4119 -2.2417 -1.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -1.2657 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -2.4571 -3.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5209 -1.2444 -4.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0663 -3.0100 -4.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4538 -2.7967 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5534 -5.4630 -0.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -5.6482 -0.0454 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2019 -4.8818 1.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -2.6725 -1.8189 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4155 -4.7680 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9812 -3.5798 -0.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8169 -2.5188 1.7772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4993 -4.2072 1.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5448 -2.9019 2.1107 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1762 -1.6494 -1.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0599 -0.9718 1.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1936 0.5668 -0.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3473 1.2372 0.7761 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0318 0.8175 2.2502 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9764 1.1809 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8710 -1.3227 2.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7564 -1.0146 0.8217 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6339 -2.7998 0.9395 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0182 -1.7444 -0.5212 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8933 -0.3978 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2467 2.3018 1.2707 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8336 1.9652 2.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2967 0.9100 2.4435 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 5.7451 1.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5817 5.2914 3.1556 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 5.0556 3.8667 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2056 3.6955 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2726 6.9244 1.7926 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7364 7.1676 0.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 1 1 3 4 1 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 18 22 1 0 22 23 1 0 11 24 1 0 24 25 1 0 24 26 1 6 24 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 38 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 47 48 1 0 6 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 52 3 1 0 47 8 1 0 22 13 1 0 43 39 1 0 1 54 1 0 1 55 1 0 1 56 1 0 4 57 1 0 4 58 1 0 4 59 1 0 5 60 1 0 5 61 1 0 6 62 1 6 8 63 1 6 9 64 1 1 10 65 1 0 10 66 1 0 10 67 1 0 11 68 1 6 13 69 1 1 15 70 1 1 16 71 1 0 16 72 1 0 16 73 1 0 17 74 1 0 17 75 1 0 18 76 1 6 20 77 1 0 20 78 1 0 20 79 1 0 21 80 1 0 21 81 1 0 21 82 1 0 22 83 1 6 23 84 1 0 25 85 1 0 25 86 1 0 25 87 1 0 26 88 1 0 27 89 1 0 27 90 1 0 28 91 1 1 29 92 1 0 29 93 1 0 29 94 1 0 32 95 1 1 33 96 1 0 33 97 1 0 33 98 1 0 34 99 1 6 35100 1 0 36101 1 1 37102 1 0 37103 1 0 37104 1 0 38105 1 6 39106 1 1 40107 1 0 40108 1 0 41109 1 0 41110 1 0 42111 1 0 42112 1 0 43113 1 0 43114 1 0 47115 1 1 48116 1 0 48117 1 0 48118 1 0 50119 1 1 51120 1 0 51121 1 0 51122 1 0 52123 1 1 53124 1 0 M END 3D SDF for NP0023921 (13-Cyclopentyl-13-desmethyl-erythromycin)Mrv1652307042108223D 124127 0 0 0 0 999 V2000 2.3002 7.4281 0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 6.0836 0.5401 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9923 5.5423 0.2471 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7904 5.7041 -1.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0798 4.0403 0.5461 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2723 3.3881 0.4332 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3860 2.2002 1.0878 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.1007 0.2676 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4546 0.1081 0.4554 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0119 0.3396 1.8489 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5722 0.0844 -0.4996 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5235 -0.8484 -0.0995 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7337 -0.4205 0.2492 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9590 -0.7387 1.5879 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8833 -2.0742 1.8464 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3589 -2.2633 3.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5859 -2.9992 0.9320 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0874 -2.4457 -0.3489 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4771 -2.8498 -0.6219 N 0 0 2 0 0 0 0 0 0 0 0 0 6.8410 -2.2127 -1.8806 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5079 -4.2794 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9406 -0.9597 -0.4794 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0498 -0.4146 0.2264 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3033 -0.2769 -1.9107 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5358 0.0194 -2.7461 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2779 0.4098 -2.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0813 -1.7906 -2.0652 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4056 -2.0866 -2.1961 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7228 -2.2136 -3.6637 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6539 -3.4028 -1.5463 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -4.3440 -1.9474 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6827 -3.5799 -0.4534 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4445 -4.9739 0.1371 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0685 -3.4164 -0.9703 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4526 -4.6130 -1.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0775 -2.9005 0.0062 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6689 -3.0949 1.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5285 -1.5114 -0.3478 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4585 -0.9610 0.6870 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9654 0.4084 0.3814 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2549 0.4616 1.2143 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.7498 -0.9428 1.3022 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.7553 -1.7779 0.5735 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4680 -0.7479 -0.7411 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9143 0.4293 -0.4704 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 1.4538 -1.1715 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0122 0.5933 0.7027 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6499 1.4863 1.7478 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3169 4.2018 0.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9871 5.1990 1.6809 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3889 4.7630 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0929 6.2100 1.0032 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9128 6.9551 0.1434 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5547 8.0627 0.7011 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2945 7.8640 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1356 7.5826 -0.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7064 5.5245 -1.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0307 4.9965 -1.5211 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3921 6.7130 -1.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7568 3.6534 -0.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 3.8760 1.5045 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4202 3.1879 -0.6698 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6806 1.5324 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.9015 0.4859 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3266 -0.5556 2.3648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8927 1.0416 1.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2396 0.8189 2.5214 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0766 1.0736 -0.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8301 0.7093 0.2099 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7905 -2.3593 1.8916 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1237 -1.4830 3.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5304 -2.1510 4.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8107 -3.2735 3.3616 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4795 -3.4117 1.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -3.9167 0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4961 -2.9050 -1.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9246 -2.1566 -2.5105 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 -1.1901 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5646 -2.8487 -2.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5207 -4.5296 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4192 -4.8733 0.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7779 -4.5461 -1.6385 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0733 -0.6039 -1.4981 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2662 -0.9978 1.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1444 0.7521 -2.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2777 0.3825 -3.7669 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1433 -0.8923 -2.8656 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6095 1.2822 -2.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6716 -2.2288 -2.8626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4119 -2.2417 -1.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -1.2657 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -2.4571 -3.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5209 -1.2444 -4.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0663 -3.0100 -4.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4538 -2.7967 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5534 -5.4630 -0.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -5.6482 -0.0454 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2019 -4.8818 1.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -2.6725 -1.8189 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4155 -4.7680 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9812 -3.5798 -0.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8169 -2.5188 1.7772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4993 -4.2072 1.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5448 -2.9019 2.1107 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1762 -1.6494 -1.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0599 -0.9718 1.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1936 0.5668 -0.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3473 1.2372 0.7761 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0318 0.8175 2.2502 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9764 1.1809 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8710 -1.3227 2.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7564 -1.0146 0.8217 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6339 -2.7998 0.9395 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0182 -1.7444 -0.5212 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8933 -0.3978 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2467 2.3018 1.2707 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8336 1.9652 2.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2967 0.9100 2.4435 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 5.7451 1.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5817 5.2914 3.1556 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 5.0556 3.8667 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2056 3.6955 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2726 6.9244 1.7926 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7364 7.1676 0.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 3 2 1 1 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 18 22 1 0 0 0 0 22 23 1 0 0 0 0 11 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 6 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 38 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 2 0 0 0 0 45 47 1 0 0 0 0 47 48 1 0 0 0 0 6 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 52 53 1 0 0 0 0 52 3 1 0 0 0 0 47 8 1 0 0 0 0 22 13 1 0 0 0 0 43 39 1 0 0 0 0 1 54 1 0 0 0 0 1 55 1 0 0 0 0 1 56 1 0 0 0 0 4 57 1 0 0 0 0 4 58 1 0 0 0 0 4 59 1 0 0 0 0 5 60 1 0 0 0 0 5 61 1 0 0 0 0 6 62 1 6 0 0 0 8 63 1 6 0 0 0 9 64 1 1 0 0 0 10 65 1 0 0 0 0 10 66 1 0 0 0 0 10 67 1 0 0 0 0 11 68 1 6 0 0 0 13 69 1 1 0 0 0 15 70 1 1 0 0 0 16 71 1 0 0 0 0 16 72 1 0 0 0 0 16 73 1 0 0 0 0 17 74 1 0 0 0 0 17 75 1 0 0 0 0 18 76 1 6 0 0 0 20 77 1 0 0 0 0 20 78 1 0 0 0 0 20 79 1 0 0 0 0 21 80 1 0 0 0 0 21 81 1 0 0 0 0 21 82 1 0 0 0 0 22 83 1 6 0 0 0 23 84 1 0 0 0 0 25 85 1 0 0 0 0 25 86 1 0 0 0 0 25 87 1 0 0 0 0 26 88 1 0 0 0 0 27 89 1 0 0 0 0 27 90 1 0 0 0 0 28 91 1 1 0 0 0 29 92 1 0 0 0 0 29 93 1 0 0 0 0 29 94 1 0 0 0 0 32 95 1 1 0 0 0 33 96 1 0 0 0 0 33 97 1 0 0 0 0 33 98 1 0 0 0 0 34 99 1 6 0 0 0 35100 1 0 0 0 0 36101 1 1 0 0 0 37102 1 0 0 0 0 37103 1 0 0 0 0 37104 1 0 0 0 0 38105 1 6 0 0 0 39106 1 1 0 0 0 40107 1 0 0 0 0 40108 1 0 0 0 0 41109 1 0 0 0 0 41110 1 0 0 0 0 42111 1 0 0 0 0 42112 1 0 0 0 0 43113 1 0 0 0 0 43114 1 0 0 0 0 47115 1 1 0 0 0 48116 1 0 0 0 0 48117 1 0 0 0 0 48118 1 0 0 0 0 50119 1 1 0 0 0 51120 1 0 0 0 0 51121 1 0 0 0 0 51122 1 0 0 0 0 52123 1 1 0 0 0 53124 1 0 0 0 0 M END > <DATABASE_ID> NP0023921 > <DATABASE_NAME> NP-MRD > <SMILES> [H]O[C@]1([H])[C@@]([H])(O[C@]2([H])[C@@]([H])(C([H])([H])[H])[C@]([H])(O[C@@]3([H])O[C@@]([H])(C([H])([H])[H])[C@]([H])(O[H])[C@](OC([H])([H])[H])(C([H])([H])[H])C3([H])[H])[C@]([H])(C(=O)O[C@]([H])(C3([H])C([H])([H])C([H])([H])C([H])([H])C3([H])[H])[C@]([H])(C([H])([H])[H])[C@]([H])(O[H])[C@]([H])(C(=O)[C@]([H])(C([H])([H])[H])C([H])([H])[C@]2(O[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])O[C@]([H])(C([H])([H])[H])C([H])([H])[C@]1([H])N(C([H])([H])[H])C([H])([H])[H] > <INCHI_IDENTIFIER> InChI=1S/C40H71NO12/c1-20-18-39(8,47)36(53-38-32(44)28(41(10)11)17-21(2)49-38)24(5)33(51-29-19-40(9,48-12)35(45)26(7)50-29)25(6)37(46)52-34(27-15-13-14-16-27)23(4)31(43)22(3)30(20)42/h20-29,31-36,38,43-45,47H,13-19H2,1-12H3/t20-,21-,22+,23-,24+,25-,26+,28+,29-,31-,32+,33+,34+,35+,36-,38-,39-,40+/m1/s1 > <INCHI_KEY> GKJQBFZXGVSLLG-NLQFPUDDSA-N > <FORMULA> C40H71NO12 > <MOLECULAR_WEIGHT> 758.003 > <EXACT_MASS> 757.49762673 > <JCHEM_ACCEPTOR_COUNT> 12 > <JCHEM_ATOM_COUNT> 124 > <JCHEM_AVERAGE_POLARIZABILITY> 83.51659385254365 > <JCHEM_BIOAVAILABILITY> 0 > <JCHEM_DONOR_COUNT> 4 > <JCHEM_FORMAL_CHARGE> 0 > <JCHEM_GHOSE_FILTER> 0 > <JCHEM_IUPAC> (3R,4S,5S,6R,7R,9R,11R,12S,13R,14R)-14-cyclopentyl-6-{[(2R,3S,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-7,12-dihydroxy-4-{[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy}-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione > <ALOGPS_LOGP> 3.26 > <JCHEM_LOGP> 4.275814672999998 > <ALOGPS_LOGS> -4.08 > <JCHEM_MDDR_LIKE_RULE> 1 > <JCHEM_NUMBER_OF_RINGS> 4 > <JCHEM_PHYSIOLOGICAL_CHARGE> 1 > <JCHEM_PKA> 13.19198776705148 > <JCHEM_PKA_STRONGEST_ACIDIC> 12.60718956957442 > <JCHEM_PKA_STRONGEST_BASIC> 8.38098701284824 > <JCHEM_POLAR_SURFACE_AREA> 173.67999999999998 > <JCHEM_REFRACTIVITY> 196.5896 > <JCHEM_ROTATABLE_BOND_COUNT> 7 > <JCHEM_RULE_OF_FIVE> 0 > <ALOGPS_SOLUBILITY> 6.36e-02 g/l > <JCHEM_TRADITIONAL_IUPAC> (3R,4S,5S,6R,7R,9R,11R,12S,13R,14R)-14-cyclopentyl-6-{[(2R,3S,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-7,12-dihydroxy-4-{[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy}-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione > <JCHEM_VEBER_RULE> 0 $$$$ 3D-SDF for NP0023921 (13-Cyclopentyl-13-desmethyl-erythromycin)RDKit 3D 124127 0 0 0 0 0 0 0 0999 V2000 2.3002 7.4281 0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 6.0836 0.5401 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9923 5.5423 0.2471 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7904 5.7041 -1.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0798 4.0403 0.5461 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2723 3.3881 0.4332 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3860 2.2002 1.0878 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.1007 0.2676 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4546 0.1081 0.4554 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0119 0.3396 1.8489 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5722 0.0844 -0.4996 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5235 -0.8484 -0.0995 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7337 -0.4205 0.2492 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9590 -0.7387 1.5879 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8833 -2.0742 1.8464 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3589 -2.2633 3.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5859 -2.9992 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 -2.4457 -0.3489 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4771 -2.8498 -0.6219 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -2.2127 -1.8806 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5079 -4.2794 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9406 -0.9597 -0.4794 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0498 -0.4146 0.2264 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3033 -0.2769 -1.9107 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5358 0.0194 -2.7461 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2779 0.4098 -2.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0813 -1.7906 -2.0652 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4056 -2.0866 -2.1961 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7228 -2.2136 -3.6637 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6539 -3.4028 -1.5463 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -4.3440 -1.9474 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6827 -3.5799 -0.4534 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4445 -4.9739 0.1371 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0685 -3.4164 -0.9703 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4526 -4.6130 -1.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0775 -2.9005 0.0062 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6689 -3.0949 1.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5285 -1.5114 -0.3478 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4585 -0.9610 0.6870 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9654 0.4084 0.3814 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2549 0.4616 1.2143 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7498 -0.9428 1.3022 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7553 -1.7779 0.5735 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 -0.7479 -0.7411 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9143 0.4293 -0.4704 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 1.4538 -1.1715 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0122 0.5933 0.7027 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6499 1.4863 1.7478 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3169 4.2018 0.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9871 5.1990 1.6809 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3889 4.7630 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0929 6.2100 1.0032 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9128 6.9551 0.1434 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5547 8.0627 0.7011 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2945 7.8640 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1356 7.5826 -0.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7064 5.5245 -1.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0307 4.9965 -1.5211 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3921 6.7130 -1.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7568 3.6534 -0.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 3.8760 1.5045 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4202 3.1879 -0.6698 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6806 1.5324 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.9015 0.4859 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3266 -0.5556 2.3648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8927 1.0416 1.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2396 0.8189 2.5214 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0766 1.0736 -0.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8301 0.7093 0.2099 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7905 -2.3593 1.8916 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1237 -1.4830 3.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5304 -2.1510 4.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8107 -3.2735 3.3616 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4795 -3.4117 1.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -3.9167 0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4961 -2.9050 -1.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9246 -2.1566 -2.5105 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 -1.1901 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5646 -2.8487 -2.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5207 -4.5296 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4192 -4.8733 0.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7779 -4.5461 -1.6385 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0733 -0.6039 -1.4981 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2662 -0.9978 1.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1444 0.7521 -2.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2777 0.3825 -3.7669 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1433 -0.8923 -2.8656 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6095 1.2822 -2.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6716 -2.2288 -2.8626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4119 -2.2417 -1.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -1.2657 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -2.4571 -3.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5209 -1.2444 -4.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0663 -3.0100 -4.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4538 -2.7967 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5534 -5.4630 -0.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -5.6482 -0.0454 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2019 -4.8818 1.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -2.6725 -1.8189 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4155 -4.7680 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9812 -3.5798 -0.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8169 -2.5188 1.7772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4993 -4.2072 1.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5448 -2.9019 2.1107 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1762 -1.6494 -1.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0599 -0.9718 1.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1936 0.5668 -0.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3473 1.2372 0.7761 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0318 0.8175 2.2502 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9764 1.1809 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8710 -1.3227 2.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7564 -1.0146 0.8217 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6339 -2.7998 0.9395 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0182 -1.7444 -0.5212 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8933 -0.3978 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2467 2.3018 1.2707 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8336 1.9652 2.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2967 0.9100 2.4435 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 5.7451 1.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5817 5.2914 3.1556 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 5.0556 3.8667 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2056 3.6955 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2726 6.9244 1.7926 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7364 7.1676 0.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 1 1 3 4 1 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 18 22 1 0 22 23 1 0 11 24 1 0 24 25 1 0 24 26 1 6 24 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 38 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 47 48 1 0 6 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 52 3 1 0 47 8 1 0 22 13 1 0 43 39 1 0 1 54 1 0 1 55 1 0 1 56 1 0 4 57 1 0 4 58 1 0 4 59 1 0 5 60 1 0 5 61 1 0 6 62 1 6 8 63 1 6 9 64 1 1 10 65 1 0 10 66 1 0 10 67 1 0 11 68 1 6 13 69 1 1 15 70 1 1 16 71 1 0 16 72 1 0 16 73 1 0 17 74 1 0 17 75 1 0 18 76 1 6 20 77 1 0 20 78 1 0 20 79 1 0 21 80 1 0 21 81 1 0 21 82 1 0 22 83 1 6 23 84 1 0 25 85 1 0 25 86 1 0 25 87 1 0 26 88 1 0 27 89 1 0 27 90 1 0 28 91 1 1 29 92 1 0 29 93 1 0 29 94 1 0 32 95 1 1 33 96 1 0 33 97 1 0 33 98 1 0 34 99 1 6 35100 1 0 36101 1 1 37102 1 0 37103 1 0 37104 1 0 38105 1 6 39106 1 1 40107 1 0 40108 1 0 41109 1 0 41110 1 0 42111 1 0 42112 1 0 43113 1 0 43114 1 0 47115 1 1 48116 1 0 48117 1 0 48118 1 0 50119 1 1 51120 1 0 51121 1 0 51122 1 0 52123 1 1 53124 1 0 M END PDB for NP0023921 (13-Cyclopentyl-13-desmethyl-erythromycin)HEADER PROTEIN 04-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 04-JUL-21 0 HETATM 1 C UNK 0 2.300 7.428 0.182 0.00 0.00 C+0 HETATM 2 O UNK 0 2.240 6.084 0.540 0.00 0.00 O+0 HETATM 3 C UNK 0 0.992 5.542 0.247 0.00 0.00 C+0 HETATM 4 C UNK 0 0.790 5.704 -1.264 0.00 0.00 C+0 HETATM 5 C UNK 0 1.080 4.040 0.546 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.272 3.388 0.433 0.00 0.00 C+0 HETATM 7 O UNK 0 -0.386 2.200 1.088 0.00 0.00 O+0 HETATM 8 C UNK 0 -0.636 1.101 0.268 0.00 0.00 C+0 HETATM 9 C UNK 0 0.455 0.108 0.455 0.00 0.00 C+0 HETATM 10 C UNK 0 1.012 0.340 1.849 0.00 0.00 C+0 HETATM 11 C UNK 0 1.572 0.084 -0.500 0.00 0.00 C+0 HETATM 12 O UNK 0 2.523 -0.848 -0.100 0.00 0.00 O+0 HETATM 13 C UNK 0 3.734 -0.421 0.249 0.00 0.00 C+0 HETATM 14 O UNK 0 3.959 -0.739 1.588 0.00 0.00 O+0 HETATM 15 C UNK 0 3.883 -2.074 1.846 0.00 0.00 C+0 HETATM 16 C UNK 0 4.359 -2.263 3.296 0.00 0.00 C+0 HETATM 17 C UNK 0 4.586 -2.999 0.932 0.00 0.00 C+0 HETATM 18 C UNK 0 5.087 -2.446 -0.349 0.00 0.00 C+0 HETATM 19 N UNK 0 6.477 -2.850 -0.622 0.00 0.00 N+0 HETATM 20 C UNK 0 6.841 -2.213 -1.881 0.00 0.00 C+0 HETATM 21 C UNK 0 6.508 -4.279 -0.858 0.00 0.00 C+0 HETATM 22 C UNK 0 4.941 -0.960 -0.479 0.00 0.00 C+0 HETATM 23 O UNK 0 6.050 -0.415 0.226 0.00 0.00 O+0 HETATM 24 C UNK 0 1.303 -0.277 -1.911 0.00 0.00 C+0 HETATM 25 C UNK 0 2.536 0.019 -2.746 0.00 0.00 C+0 HETATM 26 O UNK 0 0.278 0.410 -2.526 0.00 0.00 O+0 HETATM 27 C UNK 0 1.081 -1.791 -2.065 0.00 0.00 C+0 HETATM 28 C UNK 0 -0.406 -2.087 -2.196 0.00 0.00 C+0 HETATM 29 C UNK 0 -0.723 -2.214 -3.664 0.00 0.00 C+0 HETATM 30 C UNK 0 -0.654 -3.403 -1.546 0.00 0.00 C+0 HETATM 31 O UNK 0 0.026 -4.344 -1.947 0.00 0.00 O+0 HETATM 32 C UNK 0 -1.683 -3.580 -0.453 0.00 0.00 C+0 HETATM 33 C UNK 0 -1.444 -4.974 0.137 0.00 0.00 C+0 HETATM 34 C UNK 0 -3.068 -3.416 -0.970 0.00 0.00 C+0 HETATM 35 O UNK 0 -3.453 -4.613 -1.589 0.00 0.00 O+0 HETATM 36 C UNK 0 -4.077 -2.901 0.006 0.00 0.00 C+0 HETATM 37 C UNK 0 -3.669 -3.095 1.429 0.00 0.00 C+0 HETATM 38 C UNK 0 -4.529 -1.511 -0.348 0.00 0.00 C+0 HETATM 39 C UNK 0 -5.458 -0.961 0.687 0.00 0.00 C+0 HETATM 40 C UNK 0 -5.965 0.408 0.381 0.00 0.00 C+0 HETATM 41 C UNK 0 -7.255 0.462 1.214 0.00 0.00 C+0 HETATM 42 C UNK 0 -7.750 -0.943 1.302 0.00 0.00 C+0 HETATM 43 C UNK 0 -6.755 -1.778 0.574 0.00 0.00 C+0 HETATM 44 O UNK 0 -3.468 -0.748 -0.741 0.00 0.00 O+0 HETATM 45 C UNK 0 -2.914 0.429 -0.470 0.00 0.00 C+0 HETATM 46 O UNK 0 -3.112 1.454 -1.172 0.00 0.00 O+0 HETATM 47 C UNK 0 -2.012 0.593 0.703 0.00 0.00 C+0 HETATM 48 C UNK 0 -2.650 1.486 1.748 0.00 0.00 C+0 HETATM 49 O UNK 0 -1.317 4.202 0.816 0.00 0.00 O+0 HETATM 50 C UNK 0 -0.987 5.199 1.681 0.00 0.00 C+0 HETATM 51 C UNK 0 -0.389 4.763 2.980 0.00 0.00 C+0 HETATM 52 C UNK 0 -0.093 6.210 1.003 0.00 0.00 C+0 HETATM 53 O UNK 0 -0.913 6.955 0.143 0.00 0.00 O+0 HETATM 54 H UNK 0 1.555 8.063 0.701 0.00 0.00 H+0 HETATM 55 H UNK 0 3.295 7.864 0.405 0.00 0.00 H+0 HETATM 56 H UNK 0 2.136 7.583 -0.906 0.00 0.00 H+0 HETATM 57 H UNK 0 1.706 5.524 -1.827 0.00 0.00 H+0 HETATM 58 H UNK 0 -0.031 4.997 -1.521 0.00 0.00 H+0 HETATM 59 H UNK 0 0.392 6.713 -1.506 0.00 0.00 H+0 HETATM 60 H UNK 0 1.757 3.653 -0.261 0.00 0.00 H+0 HETATM 61 H UNK 0 1.591 3.876 1.504 0.00 0.00 H+0 HETATM 62 H UNK 0 -0.420 3.188 -0.670 0.00 0.00 H+0 HETATM 63 H UNK 0 -0.681 1.532 -0.754 0.00 0.00 H+0 HETATM 64 H UNK 0 -0.010 -0.902 0.486 0.00 0.00 H+0 HETATM 65 H UNK 0 1.327 -0.556 2.365 0.00 0.00 H+0 HETATM 66 H UNK 0 1.893 1.042 1.801 0.00 0.00 H+0 HETATM 67 H UNK 0 0.240 0.819 2.521 0.00 0.00 H+0 HETATM 68 H UNK 0 2.077 1.074 -0.469 0.00 0.00 H+0 HETATM 69 H UNK 0 3.830 0.709 0.210 0.00 0.00 H+0 HETATM 70 H UNK 0 2.791 -2.359 1.892 0.00 0.00 H+0 HETATM 71 H UNK 0 5.124 -1.483 3.506 0.00 0.00 H+0 HETATM 72 H UNK 0 3.530 -2.151 4.008 0.00 0.00 H+0 HETATM 73 H UNK 0 4.811 -3.273 3.362 0.00 0.00 H+0 HETATM 74 H UNK 0 5.479 -3.412 1.488 0.00 0.00 H+0 HETATM 75 H UNK 0 3.949 -3.917 0.756 0.00 0.00 H+0 HETATM 76 H UNK 0 4.496 -2.905 -1.181 0.00 0.00 H+0 HETATM 77 H UNK 0 5.925 -2.157 -2.510 0.00 0.00 H+0 HETATM 78 H UNK 0 7.239 -1.190 -1.736 0.00 0.00 H+0 HETATM 79 H UNK 0 7.565 -2.849 -2.460 0.00 0.00 H+0 HETATM 80 H UNK 0 7.521 -4.530 -1.283 0.00 0.00 H+0 HETATM 81 H UNK 0 6.419 -4.873 0.069 0.00 0.00 H+0 HETATM 82 H UNK 0 5.778 -4.546 -1.639 0.00 0.00 H+0 HETATM 83 H UNK 0 5.073 -0.604 -1.498 0.00 0.00 H+0 HETATM 84 H UNK 0 6.266 -0.998 1.000 0.00 0.00 H+0 HETATM 85 H UNK 0 3.144 0.752 -2.186 0.00 0.00 H+0 HETATM 86 H UNK 0 2.278 0.383 -3.767 0.00 0.00 H+0 HETATM 87 H UNK 0 3.143 -0.892 -2.866 0.00 0.00 H+0 HETATM 88 H UNK 0 0.610 1.282 -2.837 0.00 0.00 H+0 HETATM 89 H UNK 0 1.672 -2.229 -2.863 0.00 0.00 H+0 HETATM 90 H UNK 0 1.412 -2.242 -1.109 0.00 0.00 H+0 HETATM 91 H UNK 0 -0.928 -1.266 -1.706 0.00 0.00 H+0 HETATM 92 H UNK 0 -1.770 -2.457 -3.857 0.00 0.00 H+0 HETATM 93 H UNK 0 -0.521 -1.244 -4.176 0.00 0.00 H+0 HETATM 94 H UNK 0 -0.066 -3.010 -4.080 0.00 0.00 H+0 HETATM 95 H UNK 0 -1.454 -2.797 0.296 0.00 0.00 H+0 HETATM 96 H UNK 0 -0.553 -5.463 -0.308 0.00 0.00 H+0 HETATM 97 H UNK 0 -2.300 -5.648 -0.045 0.00 0.00 H+0 HETATM 98 H UNK 0 -1.202 -4.882 1.235 0.00 0.00 H+0 HETATM 99 H UNK 0 -3.010 -2.672 -1.819 0.00 0.00 H+0 HETATM 100 H UNK 0 -4.415 -4.768 -1.569 0.00 0.00 H+0 HETATM 101 H UNK 0 -4.981 -3.580 -0.126 0.00 0.00 H+0 HETATM 102 H UNK 0 -2.817 -2.519 1.777 0.00 0.00 H+0 HETATM 103 H UNK 0 -3.499 -4.207 1.544 0.00 0.00 H+0 HETATM 104 H UNK 0 -4.545 -2.902 2.111 0.00 0.00 H+0 HETATM 105 H UNK 0 -5.176 -1.649 -1.273 0.00 0.00 H+0 HETATM 106 H UNK 0 -5.060 -0.972 1.702 0.00 0.00 H+0 HETATM 107 H UNK 0 -6.194 0.567 -0.692 0.00 0.00 H+0 HETATM 108 H UNK 0 -5.347 1.237 0.776 0.00 0.00 H+0 HETATM 109 H UNK 0 -7.032 0.818 2.250 0.00 0.00 H+0 HETATM 110 H UNK 0 -7.976 1.181 0.777 0.00 0.00 H+0 HETATM 111 H UNK 0 -7.871 -1.323 2.332 0.00 0.00 H+0 HETATM 112 H UNK 0 -8.756 -1.015 0.822 0.00 0.00 H+0 HETATM 113 H UNK 0 -6.634 -2.800 0.940 0.00 0.00 H+0 HETATM 114 H UNK 0 -7.018 -1.744 -0.521 0.00 0.00 H+0 HETATM 115 H UNK 0 -1.893 -0.398 1.235 0.00 0.00 H+0 HETATM 116 H UNK 0 -3.247 2.302 1.271 0.00 0.00 H+0 HETATM 117 H UNK 0 -1.834 1.965 2.317 0.00 0.00 H+0 HETATM 118 H UNK 0 -3.297 0.910 2.443 0.00 0.00 H+0 HETATM 119 H UNK 0 -1.945 5.745 1.929 0.00 0.00 H+0 HETATM 120 H UNK 0 0.582 5.291 3.156 0.00 0.00 H+0 HETATM 121 H UNK 0 -1.025 5.056 3.867 0.00 0.00 H+0 HETATM 122 H UNK 0 -0.206 3.696 3.081 0.00 0.00 H+0 HETATM 123 H UNK 0 0.273 6.924 1.793 0.00 0.00 H+0 HETATM 124 H UNK 0 -1.736 7.168 0.684 0.00 0.00 H+0 CONECT 1 2 54 55 56 CONECT 2 1 3 CONECT 3 2 4 5 52 CONECT 4 3 57 58 59 CONECT 5 3 6 60 61 CONECT 6 5 7 49 62 CONECT 7 6 8 CONECT 8 7 9 47 63 CONECT 9 8 10 11 64 CONECT 10 9 65 66 67 CONECT 11 9 12 24 68 CONECT 12 11 13 CONECT 13 12 14 22 69 CONECT 14 13 15 CONECT 15 14 16 17 70 CONECT 16 15 71 72 73 CONECT 17 15 18 74 75 CONECT 18 17 19 22 76 CONECT 19 18 20 21 CONECT 20 19 77 78 79 CONECT 21 19 80 81 82 CONECT 22 18 23 13 83 CONECT 23 22 84 CONECT 24 11 25 26 27 CONECT 25 24 85 86 87 CONECT 26 24 88 CONECT 27 24 28 89 90 CONECT 28 27 29 30 91 CONECT 29 28 92 93 94 CONECT 30 28 31 32 CONECT 31 30 CONECT 32 30 33 34 95 CONECT 33 32 96 97 98 CONECT 34 32 35 36 99 CONECT 35 34 100 CONECT 36 34 37 38 101 CONECT 37 36 102 103 104 CONECT 38 36 39 44 105 CONECT 39 38 40 43 106 CONECT 40 39 41 107 108 CONECT 41 40 42 109 110 CONECT 42 41 43 111 112 CONECT 43 42 39 113 114 CONECT 44 38 45 CONECT 45 44 46 47 CONECT 46 45 CONECT 47 45 48 8 115 CONECT 48 47 116 117 118 CONECT 49 6 50 CONECT 50 49 51 52 119 CONECT 51 50 120 121 122 CONECT 52 50 53 3 123 CONECT 53 52 124 CONECT 54 1 CONECT 55 1 CONECT 56 1 CONECT 57 4 CONECT 58 4 CONECT 59 4 CONECT 60 5 CONECT 61 5 CONECT 62 6 CONECT 63 8 CONECT 64 9 CONECT 65 10 CONECT 66 10 CONECT 67 10 CONECT 68 11 CONECT 69 13 CONECT 70 15 CONECT 71 16 CONECT 72 16 CONECT 73 16 CONECT 74 17 CONECT 75 17 CONECT 76 18 CONECT 77 20 CONECT 78 20 CONECT 79 20 CONECT 80 21 CONECT 81 21 CONECT 82 21 CONECT 83 22 CONECT 84 23 CONECT 85 25 CONECT 86 25 CONECT 87 25 CONECT 88 26 CONECT 89 27 CONECT 90 27 CONECT 91 28 CONECT 92 29 CONECT 93 29 CONECT 94 29 CONECT 95 32 CONECT 96 33 CONECT 97 33 CONECT 98 33 CONECT 99 34 CONECT 100 35 CONECT 101 36 CONECT 102 37 CONECT 103 37 CONECT 104 37 CONECT 105 38 CONECT 106 39 CONECT 107 40 CONECT 108 40 CONECT 109 41 CONECT 110 41 CONECT 111 42 CONECT 112 42 CONECT 113 43 CONECT 114 43 CONECT 115 47 CONECT 116 48 CONECT 117 48 CONECT 118 48 CONECT 119 50 CONECT 120 51 CONECT 121 51 CONECT 122 51 CONECT 123 52 CONECT 124 53 MASTER 0 0 0 0 0 0 0 0 124 0 254 0 END SMILES for NP0023921 (13-Cyclopentyl-13-desmethyl-erythromycin)[H]O[C@]1([H])[C@@]([H])(O[C@]2([H])[C@@]([H])(C([H])([H])[H])[C@]([H])(O[C@@]3([H])O[C@@]([H])(C([H])([H])[H])[C@]([H])(O[H])[C@](OC([H])([H])[H])(C([H])([H])[H])C3([H])[H])[C@]([H])(C(=O)O[C@]([H])(C3([H])C([H])([H])C([H])([H])C([H])([H])C3([H])[H])[C@]([H])(C([H])([H])[H])[C@]([H])(O[H])[C@]([H])(C(=O)[C@]([H])(C([H])([H])[H])C([H])([H])[C@]2(O[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])O[C@]([H])(C([H])([H])[H])C([H])([H])[C@]1([H])N(C([H])([H])[H])C([H])([H])[H] INCHI for NP0023921 (13-Cyclopentyl-13-desmethyl-erythromycin)InChI=1S/C40H71NO12/c1-20-18-39(8,47)36(53-38-32(44)28(41(10)11)17-21(2)49-38)24(5)33(51-29-19-40(9,48-12)35(45)26(7)50-29)25(6)37(46)52-34(27-15-13-14-16-27)23(4)31(43)22(3)30(20)42/h20-29,31-36,38,43-45,47H,13-19H2,1-12H3/t20-,21-,22+,23-,24+,25-,26+,28+,29-,31-,32+,33+,34+,35+,36-,38-,39-,40+/m1/s1 3D Structure for NP0023921 (13-Cyclopentyl-13-desmethyl-erythromycin) | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Synonyms | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Chemical Formula | C40H71NO12 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Average Mass | 758.0030 Da | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Monoisotopic Mass | 757.49763 Da | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
IUPAC Name | (3R,4S,5S,6R,7R,9R,11R,12S,13R,14R)-14-cyclopentyl-6-{[(2R,3S,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-7,12-dihydroxy-4-{[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy}-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Traditional Name | (3R,4S,5S,6R,7R,9R,11R,12S,13R,14R)-14-cyclopentyl-6-{[(2R,3S,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-7,12-dihydroxy-4-{[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy}-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
CAS Registry Number | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
SMILES | COC1(C)CC(O[C@H]2[C@H](C)[C@@H](OC3OC(C)CC(C3O)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@@H](C)[C@H](OC(=O)[C@@H]2C)C2CCCC2)OC(C)C1O | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
InChI Identifier | InChI=1S/C40H71NO12/c1-20-18-39(8,47)36(53-38-32(44)28(41(10)11)17-21(2)49-38)24(5)33(51-29-19-40(9,48-12)35(45)26(7)50-29)25(6)37(46)52-34(27-15-13-14-16-27)23(4)31(43)22(3)30(20)42/h20-29,31-36,38,43-45,47H,13-19H2,1-12H3/t20-,21?,22+,23-,24+,25-,26?,28?,29?,31-,32?,33+,34+,35?,36-,38?,39-,40?/m1/s1 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
InChI Key | GKJQBFZXGVSLLG-NLQFPUDDSA-N | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Experimental Spectra | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Not Available | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Predicted Spectra | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
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Chemical Shift Submissions | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Not Available | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Species | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Species of Origin |
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Chemical Taxonomy | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Classification | Not classified | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Physical Properties | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
State | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Experimental Properties |
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Predicted Properties |
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External Links | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
NPAtlas ID | NPA013674 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
HMDB ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
DrugBank ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Phenol Explorer Compound ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
FoodDB ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
KNApSAcK ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Chemspider ID | 78445536 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
KEGG Compound ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
BioCyc ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
BiGG ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Wikipedia Link | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
METLIN ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
PubChem Compound | 139586884 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
PDB ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
ChEBI ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Good Scents ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
References | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
General References |