Showing NP-Card for Naphthomycin K (NP0001803)
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Version | 1.0 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Created at | 2020-10-21 16:38:20 UTC | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Updated at | 2021-07-15 16:45:18 UTC | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
NP-MRD ID | NP0001803 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Secondary Accession Numbers | None | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Natural Product Identification | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Common Name | Naphthomycin K | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Provided By | NPAtlas![]() | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Description | Naphthomycin K is found in Streptomyces and Streptomyces sp. (strain Go 40/10). It was first documented in 1999 (PMID: 10513843). Based on a literature review very few articles have been published on (7Z,9R,10S,11S,12Z,14S,16Z,20S,21S,22Z,24Z,26Z)-4,10,14,20,28,34-hexahydroxy-9-(hydroxymethyl)-3,7,11,17,21-pentamethyl-29-azatricyclo[28.3.1.0⁵,³³]Tetratriaconta-1(33),2,4,7,12,16,22,24,26,28,30(34)-undecaene-6,18,31,32-tetrone. | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Structure | MOL for NP0001803 (Naphthomycin K)Mrv1652307012117063D 96 98 0 0 0 0 999 V2000 -4.4083 -1.7059 -3.8209 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2835 -1.6241 -2.3119 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5652 -2.5252 -1.6648 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -2.1797 -0.4880 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4543 -3.0111 -0.5691 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7512 -4.3113 -0.1103 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -2.3203 0.3906 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6115 -1.8874 -0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5731 -2.7817 -0.6351 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3103 -4.2459 -0.5526 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9925 -2.5571 -0.1675 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7079 -3.7463 -0.2114 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0908 -1.9607 1.2022 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5163 -3.0292 2.1950 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2486 -4.2043 2.1111 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4827 -1.8966 1.6175 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0309 -0.7553 1.9001 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7074 -0.5675 3.2775 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0465 0.3191 0.9302 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1369 1.0497 1.0896 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2514 0.8523 -0.1583 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8561 0.7989 -1.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 0.2311 -1.5813 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3043 1.2452 -2.5748 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0239 1.1435 -3.8873 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0711 1.7986 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3717 1.9079 -1.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9612 1.4374 -0.1372 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1097 1.6319 1.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2768 1.3497 2.2746 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7672 2.2566 0.8765 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2501 2.2859 2.1008 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2184 2.7179 -0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0272 2.5397 -1.4364 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7811 2.9182 -2.8443 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1405 3.3111 -0.4842 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4089 4.6862 -0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8939 5.3647 -1.1214 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1918 5.3484 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8629 5.0664 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1908 4.5735 2.4199 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6148 3.3672 2.8496 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9462 2.1295 2.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9045 1.4337 1.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0811 1.2794 0.5558 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9054 2.5345 0.4498 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8906 0.0721 0.8823 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9536 0.3937 1.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -0.6909 -0.2236 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9459 -0.5689 -1.5672 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 0.5477 -2.1691 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7103 -2.4060 -4.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2942 -0.7149 -4.2576 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4465 -2.0768 -4.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5481 -3.5636 -1.9969 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2762 -2.4903 0.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4202 -1.1311 -0.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.9872 -1.6092 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9407 -4.8761 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -2.2075 1.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9072 -0.8175 0.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5668 -2.5302 -1.7387 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8846 -4.6022 0.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6226 -4.6106 -1.3634 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2563 -4.8344 -0.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4992 -1.8509 -0.8686 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2245 -3.8071 -1.0533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 -1.1282 1.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7776 -2.6025 3.2166 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4567 -3.0991 2.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9618 -4.2521 2.7844 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9913 -2.8903 1.6724 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5563 0.1443 3.1465 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0169 -0.0896 3.9883 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1456 -1.5199 3.5864 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6234 0.1761 -2.4524 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0486 1.5817 -3.8137 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1773 0.0601 -4.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4306 1.6365 -4.6851 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6009 2.1583 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3808 3.6462 -3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0833 2.8325 -0.7889 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 6.1674 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1537 5.3290 3.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1388 5.1874 2.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5685 3.3244 3.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3781 1.5974 3.4016 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9716 0.9526 1.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6454 1.1056 -0.4481 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4663 2.7435 1.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7211 2.3944 -0.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2925 3.3478 0.0673 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2072 -0.5831 1.5063 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2723 -0.4885 2.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6121 -0.4713 -0.3036 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5259 -1.7765 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 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 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 33 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 42 43 1 0 0 0 0 43 44 2 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 2 0 0 0 0 50 2 1 0 0 0 0 28 21 1 0 0 0 0 34 27 1 0 0 0 0 1 52 1 0 0 0 0 1 53 1 0 0 0 0 1 54 1 0 0 0 0 3 55 1 0 0 0 0 4 56 1 0 0 0 0 4 57 1 0 0 0 0 5 58 1 6 0 0 0 6 59 1 0 0 0 0 7 60 1 0 0 0 0 8 61 1 0 0 0 0 9 62 1 6 0 0 0 10 63 1 0 0 0 0 10 64 1 0 0 0 0 10 65 1 0 0 0 0 11 66 1 6 0 0 0 12 67 1 0 0 0 0 13 68 1 6 0 0 0 14 69 1 0 0 0 0 14 70 1 0 0 0 0 15 71 1 0 0 0 0 16 72 1 0 0 0 0 18 73 1 0 0 0 0 18 74 1 0 0 0 0 18 75 1 0 0 0 0 23 76 1 0 0 0 0 25 77 1 0 0 0 0 25 78 1 0 0 0 0 25 79 1 0 0 0 0 26 80 1 0 0 0 0 35 81 1 0 0 0 0 36 82 1 0 0 0 0 39 83 1 0 0 0 0 40 84 1 0 0 0 0 41 85 1 0 0 0 0 42 86 1 0 0 0 0 43 87 1 0 0 0 0 44 88 1 0 0 0 0 45 89 1 6 0 0 0 46 90 1 0 0 0 0 46 91 1 0 0 0 0 46 92 1 0 0 0 0 47 93 1 1 0 0 0 48 94 1 0 0 0 0 49 95 1 0 0 0 0 49 96 1 0 0 0 0 M END 3D MOL for NP0001803 (Naphthomycin K)RDKit 3D 96 98 0 0 0 0 0 0 0 0999 V2000 -4.4083 -1.7059 -3.8209 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2835 -1.6241 -2.3119 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5652 -2.5252 -1.6648 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -2.1797 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4543 -3.0111 -0.5691 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7512 -4.3113 -0.1103 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -2.3203 0.3906 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6115 -1.8874 -0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5731 -2.7817 -0.6351 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3103 -4.2459 -0.5526 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9925 -2.5571 -0.1675 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7079 -3.7463 -0.2114 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0908 -1.9607 1.2022 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5163 -3.0292 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2486 -4.2043 2.1111 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4827 -1.8966 1.6175 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0309 -0.7553 1.9001 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7074 -0.5675 3.2775 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0465 0.3191 0.9302 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1369 1.0497 1.0896 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2514 0.8523 -0.1583 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8561 0.7989 -1.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 0.2311 -1.5813 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3043 1.2452 -2.5748 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0239 1.1435 -3.8873 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0711 1.7986 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3717 1.9079 -1.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9612 1.4374 -0.1372 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1097 1.6319 1.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2768 1.3497 2.2746 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7672 2.2566 0.8765 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2501 2.2859 2.1008 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2184 2.7179 -0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0272 2.5397 -1.4364 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7811 2.9182 -2.8443 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1405 3.3111 -0.4842 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4089 4.6862 -0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8939 5.3647 -1.1214 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1918 5.3484 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8629 5.0664 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1908 4.5735 2.4199 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6148 3.3672 2.8496 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9462 2.1295 2.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9045 1.4337 1.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0811 1.2794 0.5558 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9054 2.5345 0.4498 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8906 0.0721 0.8823 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9536 0.3937 1.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -0.6909 -0.2236 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9459 -0.5689 -1.5672 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 0.5477 -2.1691 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7103 -2.4060 -4.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2942 -0.7149 -4.2576 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4465 -2.0768 -4.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5481 -3.5636 -1.9969 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2762 -2.4903 0.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4202 -1.1311 -0.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.9872 -1.6092 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9407 -4.8761 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -2.2075 1.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9072 -0.8175 0.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5668 -2.5302 -1.7387 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8846 -4.6022 0.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6226 -4.6106 -1.3634 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2563 -4.8344 -0.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4992 -1.8509 -0.8686 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2245 -3.8071 -1.0533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 -1.1282 1.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7776 -2.6025 3.2166 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4567 -3.0991 2.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9618 -4.2521 2.7844 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9913 -2.8903 1.6724 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5563 0.1443 3.1465 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0169 -0.0896 3.9883 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1456 -1.5199 3.5864 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6234 0.1761 -2.4524 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0486 1.5817 -3.8137 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1773 0.0601 -4.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4306 1.6365 -4.6851 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6009 2.1583 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3808 3.6462 -3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0833 2.8325 -0.7889 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 6.1674 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1537 5.3290 3.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1388 5.1874 2.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5685 3.3244 3.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3781 1.5974 3.4016 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9716 0.9526 1.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6454 1.1056 -0.4481 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4663 2.7435 1.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7211 2.3944 -0.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2925 3.3478 0.0673 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2072 -0.5831 1.5063 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2723 -0.4885 2.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6121 -0.4713 -0.3036 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5259 -1.7765 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 1 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 13 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 2 0 19 21 1 0 21 22 2 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 29 31 1 0 31 32 2 0 31 33 1 0 33 34 2 0 34 35 1 0 33 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 40 2 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 1 0 45 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 50 51 2 0 50 2 1 0 28 21 1 0 34 27 1 0 1 52 1 0 1 53 1 0 1 54 1 0 3 55 1 0 4 56 1 0 4 57 1 0 5 58 1 6 6 59 1 0 7 60 1 0 8 61 1 0 9 62 1 6 10 63 1 0 10 64 1 0 10 65 1 0 11 66 1 6 12 67 1 0 13 68 1 6 14 69 1 0 14 70 1 0 15 71 1 0 16 72 1 0 18 73 1 0 18 74 1 0 18 75 1 0 23 76 1 0 25 77 1 0 25 78 1 0 25 79 1 0 26 80 1 0 35 81 1 0 36 82 1 0 39 83 1 0 40 84 1 0 41 85 1 0 42 86 1 0 43 87 1 0 44 88 1 0 45 89 1 6 46 90 1 0 46 91 1 0 46 92 1 0 47 93 1 1 48 94 1 0 49 95 1 0 49 96 1 0 M END 3D SDF for NP0001803 (Naphthomycin K)Mrv1652307012117063D 96 98 0 0 0 0 999 V2000 -4.4083 -1.7059 -3.8209 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2835 -1.6241 -2.3119 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5652 -2.5252 -1.6648 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -2.1797 -0.4880 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4543 -3.0111 -0.5691 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7512 -4.3113 -0.1103 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -2.3203 0.3906 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6115 -1.8874 -0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5731 -2.7817 -0.6351 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3103 -4.2459 -0.5526 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9925 -2.5571 -0.1675 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7079 -3.7463 -0.2114 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0908 -1.9607 1.2022 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5163 -3.0292 2.1950 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2486 -4.2043 2.1111 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4827 -1.8966 1.6175 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0309 -0.7553 1.9001 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7074 -0.5675 3.2775 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0465 0.3191 0.9302 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1369 1.0497 1.0896 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2514 0.8523 -0.1583 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8561 0.7989 -1.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 0.2311 -1.5813 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3043 1.2452 -2.5748 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0239 1.1435 -3.8873 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0711 1.7986 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3717 1.9079 -1.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9612 1.4374 -0.1372 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1097 1.6319 1.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2768 1.3497 2.2746 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7672 2.2566 0.8765 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2501 2.2859 2.1008 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2184 2.7179 -0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0272 2.5397 -1.4364 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7811 2.9182 -2.8443 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1405 3.3111 -0.4842 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4089 4.6862 -0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8939 5.3647 -1.1214 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1918 5.3484 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8629 5.0664 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1908 4.5735 2.4199 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6148 3.3672 2.8496 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9462 2.1295 2.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9045 1.4337 1.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0811 1.2794 0.5558 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9054 2.5345 0.4498 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8906 0.0721 0.8823 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9536 0.3937 1.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -0.6909 -0.2236 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9459 -0.5689 -1.5672 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 0.5477 -2.1691 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7103 -2.4060 -4.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2942 -0.7149 -4.2576 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4465 -2.0768 -4.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5481 -3.5636 -1.9969 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2762 -2.4903 0.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4202 -1.1311 -0.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.9872 -1.6092 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9407 -4.8761 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -2.2075 1.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9072 -0.8175 0.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5668 -2.5302 -1.7387 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8846 -4.6022 0.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6226 -4.6106 -1.3634 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2563 -4.8344 -0.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4992 -1.8509 -0.8686 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2245 -3.8071 -1.0533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 -1.1282 1.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7776 -2.6025 3.2166 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4567 -3.0991 2.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9618 -4.2521 2.7844 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9913 -2.8903 1.6724 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5563 0.1443 3.1465 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0169 -0.0896 3.9883 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1456 -1.5199 3.5864 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6234 0.1761 -2.4524 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0486 1.5817 -3.8137 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1773 0.0601 -4.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4306 1.6365 -4.6851 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6009 2.1583 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3808 3.6462 -3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0833 2.8325 -0.7889 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 6.1674 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1537 5.3290 3.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1388 5.1874 2.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5685 3.3244 3.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3781 1.5974 3.4016 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9716 0.9526 1.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6454 1.1056 -0.4481 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4663 2.7435 1.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7211 2.3944 -0.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2925 3.3478 0.0673 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2072 -0.5831 1.5063 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2723 -0.4885 2.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6121 -0.4713 -0.3036 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5259 -1.7765 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 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 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 33 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 42 43 1 0 0 0 0 43 44 2 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 2 0 0 0 0 50 2 1 0 0 0 0 28 21 1 0 0 0 0 34 27 1 0 0 0 0 1 52 1 0 0 0 0 1 53 1 0 0 0 0 1 54 1 0 0 0 0 3 55 1 0 0 0 0 4 56 1 0 0 0 0 4 57 1 0 0 0 0 5 58 1 6 0 0 0 6 59 1 0 0 0 0 7 60 1 0 0 0 0 8 61 1 0 0 0 0 9 62 1 6 0 0 0 10 63 1 0 0 0 0 10 64 1 0 0 0 0 10 65 1 0 0 0 0 11 66 1 6 0 0 0 12 67 1 0 0 0 0 13 68 1 6 0 0 0 14 69 1 0 0 0 0 14 70 1 0 0 0 0 15 71 1 0 0 0 0 16 72 1 0 0 0 0 18 73 1 0 0 0 0 18 74 1 0 0 0 0 18 75 1 0 0 0 0 23 76 1 0 0 0 0 25 77 1 0 0 0 0 25 78 1 0 0 0 0 25 79 1 0 0 0 0 26 80 1 0 0 0 0 35 81 1 0 0 0 0 36 82 1 0 0 0 0 39 83 1 0 0 0 0 40 84 1 0 0 0 0 41 85 1 0 0 0 0 42 86 1 0 0 0 0 43 87 1 0 0 0 0 44 88 1 0 0 0 0 45 89 1 6 0 0 0 46 90 1 0 0 0 0 46 91 1 0 0 0 0 46 92 1 0 0 0 0 47 93 1 1 0 0 0 48 94 1 0 0 0 0 49 95 1 0 0 0 0 49 96 1 0 0 0 0 M END > <DATABASE_ID> NP0001803 > <DATABASE_NAME> NP-MRD > <SMILES> [H]OC1=C2N([H])C(=O)\C([H])=C(\[H])/C(/[H])=C(/[H])\C(\[H])=C([H])/[C@]([H])(C([H])([H])[H])[C@@]([H])(O[H])C([H])([H])C(=O)\C(=C([H])/C([H])([H])[C@]([H])(O[H])\C([H])=C([H])/[C@]([H])(C([H])([H])[H])[C@]([H])(O[H])[C@]([H])(\C([H])=C(/C(=O)C3=C(O[H])C(=C([H])C1=C3C(=O)C2=O)C([H])([H])[H])C([H])([H])[H])C([H])([H])O[H])C([H])([H])[H] > <INCHI_IDENTIFIER> InChI=1S/C39H45NO11/c1-20-10-8-6-7-9-11-30(45)40-33-37(49)27-17-24(5)36(48)32(31(27)38(50)39(33)51)35(47)23(4)16-25(19-41)34(46)22(3)13-15-26(42)14-12-21(2)29(44)18-28(20)43/h6-13,15-17,20,22,25-26,28,34,41-43,46,48-49H,14,18-19H2,1-5H3,(H,40,45)/b7-6-,10-8-,11-9-,15-13-,21-12-,23-16-/t20-,22-,25+,26-,28-,34-/m0/s1 > <INCHI_KEY> NDPMXTPKMIGGDH-KAFVZXQCSA-N > <FORMULA> C39H45NO11 > <MOLECULAR_WEIGHT> 703.785 > <EXACT_MASS> 703.299261273 > <JCHEM_ACCEPTOR_COUNT> 11 > <JCHEM_ATOM_COUNT> 96 > <JCHEM_AVERAGE_POLARIZABILITY> 73.48199395483906 > <JCHEM_BIOAVAILABILITY> 0 > <JCHEM_DONOR_COUNT> 7 > <JCHEM_FORMAL_CHARGE> 0 > <JCHEM_GHOSE_FILTER> 0 > <JCHEM_IUPAC> (7Z,9R,10S,11S,12Z,14S,16Z,20S,21S,22Z,24Z,26Z)-4,10,14,20,34-pentahydroxy-9-(hydroxymethyl)-3,7,11,17,21-pentamethyl-29-azatricyclo[28.3.1.0^{5,33}]tetratriaconta-1(33),2,4,7,12,16,22,24,26,30(34)-decaene-6,18,28,31,32-pentone > <ALOGPS_LOGP> 2.83 > <JCHEM_LOGP> 3.3993216356666673 > <ALOGPS_LOGS> -5.12 > <JCHEM_MDDR_LIKE_RULE> 0 > <JCHEM_NUMBER_OF_RINGS> 3 > <JCHEM_PHYSIOLOGICAL_CHARGE> -2 > <JCHEM_PKA> 6.785669194910887 > <JCHEM_PKA_STRONGEST_ACIDIC> 5.631534536957245 > <JCHEM_PKA_STRONGEST_BASIC> -1.6406787476142792 > <JCHEM_POLAR_SURFACE_AREA> 218.75999999999996 > <JCHEM_REFRACTIVITY> 200.15000000000003 > <JCHEM_ROTATABLE_BOND_COUNT> 1 > <JCHEM_RULE_OF_FIVE> 0 > <ALOGPS_SOLUBILITY> 5.30e-03 g/l > <JCHEM_TRADITIONAL_IUPAC> (7Z,9R,10S,11S,12Z,14S,16Z,20S,21S,22Z,24Z,26Z)-4,10,14,20,34-pentahydroxy-9-(hydroxymethyl)-3,7,11,17,21-pentamethyl-29-azatricyclo[28.3.1.0^{5,33}]tetratriaconta-1(33),2,4,7,12,16,22,24,26,30(34)-decaene-6,18,28,31,32-pentone > <JCHEM_VEBER_RULE> 0 $$$$ 3D-SDF for NP0001803 (Naphthomycin K)RDKit 3D 96 98 0 0 0 0 0 0 0 0999 V2000 -4.4083 -1.7059 -3.8209 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2835 -1.6241 -2.3119 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5652 -2.5252 -1.6648 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -2.1797 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4543 -3.0111 -0.5691 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7512 -4.3113 -0.1103 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -2.3203 0.3906 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6115 -1.8874 -0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5731 -2.7817 -0.6351 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3103 -4.2459 -0.5526 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9925 -2.5571 -0.1675 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7079 -3.7463 -0.2114 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0908 -1.9607 1.2022 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5163 -3.0292 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2486 -4.2043 2.1111 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4827 -1.8966 1.6175 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0309 -0.7553 1.9001 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7074 -0.5675 3.2775 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0465 0.3191 0.9302 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1369 1.0497 1.0896 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2514 0.8523 -0.1583 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8561 0.7989 -1.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 0.2311 -1.5813 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3043 1.2452 -2.5748 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0239 1.1435 -3.8873 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0711 1.7986 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3717 1.9079 -1.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9612 1.4374 -0.1372 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1097 1.6319 1.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2768 1.3497 2.2746 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7672 2.2566 0.8765 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2501 2.2859 2.1008 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2184 2.7179 -0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0272 2.5397 -1.4364 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7811 2.9182 -2.8443 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1405 3.3111 -0.4842 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4089 4.6862 -0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8939 5.3647 -1.1214 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1918 5.3484 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8629 5.0664 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1908 4.5735 2.4199 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6148 3.3672 2.8496 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9462 2.1295 2.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9045 1.4337 1.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0811 1.2794 0.5558 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9054 2.5345 0.4498 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8906 0.0721 0.8823 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9536 0.3937 1.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -0.6909 -0.2236 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9459 -0.5689 -1.5672 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 0.5477 -2.1691 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7103 -2.4060 -4.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2942 -0.7149 -4.2576 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4465 -2.0768 -4.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5481 -3.5636 -1.9969 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2762 -2.4903 0.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4202 -1.1311 -0.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.9872 -1.6092 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9407 -4.8761 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -2.2075 1.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9072 -0.8175 0.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5668 -2.5302 -1.7387 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8846 -4.6022 0.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6226 -4.6106 -1.3634 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2563 -4.8344 -0.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4992 -1.8509 -0.8686 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2245 -3.8071 -1.0533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 -1.1282 1.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7776 -2.6025 3.2166 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4567 -3.0991 2.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9618 -4.2521 2.7844 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9913 -2.8903 1.6724 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5563 0.1443 3.1465 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0169 -0.0896 3.9883 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1456 -1.5199 3.5864 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6234 0.1761 -2.4524 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0486 1.5817 -3.8137 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1773 0.0601 -4.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4306 1.6365 -4.6851 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6009 2.1583 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3808 3.6462 -3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0833 2.8325 -0.7889 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 6.1674 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1537 5.3290 3.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1388 5.1874 2.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5685 3.3244 3.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3781 1.5974 3.4016 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9716 0.9526 1.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6454 1.1056 -0.4481 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4663 2.7435 1.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7211 2.3944 -0.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2925 3.3478 0.0673 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2072 -0.5831 1.5063 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2723 -0.4885 2.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6121 -0.4713 -0.3036 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5259 -1.7765 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 1 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 13 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 2 0 19 21 1 0 21 22 2 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 29 31 1 0 31 32 2 0 31 33 1 0 33 34 2 0 34 35 1 0 33 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 40 2 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 1 0 45 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 50 51 2 0 50 2 1 0 28 21 1 0 34 27 1 0 1 52 1 0 1 53 1 0 1 54 1 0 3 55 1 0 4 56 1 0 4 57 1 0 5 58 1 6 6 59 1 0 7 60 1 0 8 61 1 0 9 62 1 6 10 63 1 0 10 64 1 0 10 65 1 0 11 66 1 6 12 67 1 0 13 68 1 6 14 69 1 0 14 70 1 0 15 71 1 0 16 72 1 0 18 73 1 0 18 74 1 0 18 75 1 0 23 76 1 0 25 77 1 0 25 78 1 0 25 79 1 0 26 80 1 0 35 81 1 0 36 82 1 0 39 83 1 0 40 84 1 0 41 85 1 0 42 86 1 0 43 87 1 0 44 88 1 0 45 89 1 6 46 90 1 0 46 91 1 0 46 92 1 0 47 93 1 1 48 94 1 0 49 95 1 0 49 96 1 0 M END PDB for NP0001803 (Naphthomycin K)HEADER PROTEIN 01-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 01-JUL-21 0 HETATM 1 C UNK 0 -4.408 -1.706 -3.821 0.00 0.00 C+0 HETATM 2 C UNK 0 -4.284 -1.624 -2.312 0.00 0.00 C+0 HETATM 3 C UNK 0 -3.565 -2.525 -1.665 0.00 0.00 C+0 HETATM 4 C UNK 0 -2.768 -2.180 -0.488 0.00 0.00 C+0 HETATM 5 C UNK 0 -1.454 -3.011 -0.569 0.00 0.00 C+0 HETATM 6 O UNK 0 -1.751 -4.311 -0.110 0.00 0.00 O+0 HETATM 7 C UNK 0 -0.564 -2.320 0.391 0.00 0.00 C+0 HETATM 8 C UNK 0 0.612 -1.887 -0.004 0.00 0.00 C+0 HETATM 9 C UNK 0 1.573 -2.782 -0.635 0.00 0.00 C+0 HETATM 10 C UNK 0 1.310 -4.246 -0.553 0.00 0.00 C+0 HETATM 11 C UNK 0 2.993 -2.557 -0.168 0.00 0.00 C+0 HETATM 12 O UNK 0 3.708 -3.746 -0.211 0.00 0.00 O+0 HETATM 13 C UNK 0 3.091 -1.961 1.202 0.00 0.00 C+0 HETATM 14 C UNK 0 2.516 -3.029 2.195 0.00 0.00 C+0 HETATM 15 O UNK 0 3.249 -4.204 2.111 0.00 0.00 O+0 HETATM 16 C UNK 0 4.483 -1.897 1.617 0.00 0.00 C+0 HETATM 17 C UNK 0 5.031 -0.755 1.900 0.00 0.00 C+0 HETATM 18 C UNK 0 5.707 -0.568 3.277 0.00 0.00 C+0 HETATM 19 C UNK 0 5.046 0.319 0.930 0.00 0.00 C+0 HETATM 20 O UNK 0 6.137 1.050 1.090 0.00 0.00 O+0 HETATM 21 C UNK 0 4.251 0.852 -0.158 0.00 0.00 C+0 HETATM 22 C UNK 0 4.856 0.799 -1.439 0.00 0.00 C+0 HETATM 23 O UNK 0 6.171 0.231 -1.581 0.00 0.00 O+0 HETATM 24 C UNK 0 4.304 1.245 -2.575 0.00 0.00 C+0 HETATM 25 C UNK 0 5.024 1.143 -3.887 0.00 0.00 C+0 HETATM 26 C UNK 0 3.071 1.799 -2.531 0.00 0.00 C+0 HETATM 27 C UNK 0 2.372 1.908 -1.309 0.00 0.00 C+0 HETATM 28 C UNK 0 2.961 1.437 -0.137 0.00 0.00 C+0 HETATM 29 C UNK 0 2.110 1.632 1.001 0.00 0.00 C+0 HETATM 30 O UNK 0 2.277 1.350 2.275 0.00 0.00 O+0 HETATM 31 C UNK 0 0.767 2.257 0.877 0.00 0.00 C+0 HETATM 32 O UNK 0 0.250 2.286 2.101 0.00 0.00 O+0 HETATM 33 C UNK 0 0.218 2.718 -0.402 0.00 0.00 C+0 HETATM 34 C UNK 0 1.027 2.540 -1.436 0.00 0.00 C+0 HETATM 35 O UNK 0 0.781 2.918 -2.844 0.00 0.00 O+0 HETATM 36 N UNK 0 -1.141 3.311 -0.484 0.00 0.00 N+0 HETATM 37 C UNK 0 -1.409 4.686 -0.152 0.00 0.00 C+0 HETATM 38 O UNK 0 -1.894 5.365 -1.121 0.00 0.00 O+0 HETATM 39 C UNK 0 -1.192 5.348 1.110 0.00 0.00 C+0 HETATM 40 C UNK 0 -1.863 5.066 2.242 0.00 0.00 C+0 HETATM 41 C UNK 0 -3.191 4.574 2.420 0.00 0.00 C+0 HETATM 42 C UNK 0 -3.615 3.367 2.850 0.00 0.00 C+0 HETATM 43 C UNK 0 -2.946 2.130 2.596 0.00 0.00 C+0 HETATM 44 C UNK 0 -2.905 1.434 1.476 0.00 0.00 C+0 HETATM 45 C UNK 0 -4.081 1.279 0.556 0.00 0.00 C+0 HETATM 46 C UNK 0 -4.905 2.535 0.450 0.00 0.00 C+0 HETATM 47 C UNK 0 -4.891 0.072 0.882 0.00 0.00 C+0 HETATM 48 O UNK 0 -5.954 0.394 1.774 0.00 0.00 O+0 HETATM 49 C UNK 0 -5.492 -0.691 -0.224 0.00 0.00 C+0 HETATM 50 C UNK 0 -4.946 -0.569 -1.567 0.00 0.00 C+0 HETATM 51 O UNK 0 -5.045 0.548 -2.169 0.00 0.00 O+0 HETATM 52 H UNK 0 -3.710 -2.406 -4.268 0.00 0.00 H+0 HETATM 53 H UNK 0 -4.294 -0.715 -4.258 0.00 0.00 H+0 HETATM 54 H UNK 0 -5.447 -2.077 -4.008 0.00 0.00 H+0 HETATM 55 H UNK 0 -3.548 -3.564 -1.997 0.00 0.00 H+0 HETATM 56 H UNK 0 -3.276 -2.490 0.461 0.00 0.00 H+0 HETATM 57 H UNK 0 -2.420 -1.131 -0.484 0.00 0.00 H+0 HETATM 58 H UNK 0 -1.164 -2.987 -1.609 0.00 0.00 H+0 HETATM 59 H UNK 0 -1.941 -4.876 -0.911 0.00 0.00 H+0 HETATM 60 H UNK 0 -0.972 -2.208 1.406 0.00 0.00 H+0 HETATM 61 H UNK 0 0.907 -0.818 0.137 0.00 0.00 H+0 HETATM 62 H UNK 0 1.567 -2.530 -1.739 0.00 0.00 H+0 HETATM 63 H UNK 0 0.885 -4.602 0.403 0.00 0.00 H+0 HETATM 64 H UNK 0 0.623 -4.611 -1.363 0.00 0.00 H+0 HETATM 65 H UNK 0 2.256 -4.834 -0.785 0.00 0.00 H+0 HETATM 66 H UNK 0 3.499 -1.851 -0.869 0.00 0.00 H+0 HETATM 67 H UNK 0 4.224 -3.807 -1.053 0.00 0.00 H+0 HETATM 68 H UNK 0 2.435 -1.128 1.376 0.00 0.00 H+0 HETATM 69 H UNK 0 2.778 -2.603 3.217 0.00 0.00 H+0 HETATM 70 H UNK 0 1.457 -3.099 2.171 0.00 0.00 H+0 HETATM 71 H UNK 0 3.962 -4.252 2.784 0.00 0.00 H+0 HETATM 72 H UNK 0 4.991 -2.890 1.672 0.00 0.00 H+0 HETATM 73 H UNK 0 6.556 0.144 3.147 0.00 0.00 H+0 HETATM 74 H UNK 0 5.017 -0.090 3.988 0.00 0.00 H+0 HETATM 75 H UNK 0 6.146 -1.520 3.586 0.00 0.00 H+0 HETATM 76 H UNK 0 6.623 0.176 -2.452 0.00 0.00 H+0 HETATM 77 H UNK 0 6.049 1.582 -3.814 0.00 0.00 H+0 HETATM 78 H UNK 0 5.177 0.060 -4.069 0.00 0.00 H+0 HETATM 79 H UNK 0 4.431 1.637 -4.685 0.00 0.00 H+0 HETATM 80 H UNK 0 2.601 2.158 -3.452 0.00 0.00 H+0 HETATM 81 H UNK 0 1.381 3.646 -3.225 0.00 0.00 H+0 HETATM 82 H UNK 0 -2.083 2.833 -0.789 0.00 0.00 H+0 HETATM 83 H UNK 0 -0.390 6.167 1.136 0.00 0.00 H+0 HETATM 84 H UNK 0 -1.154 5.329 3.104 0.00 0.00 H+0 HETATM 85 H UNK 0 -4.139 5.187 2.240 0.00 0.00 H+0 HETATM 86 H UNK 0 -4.569 3.324 3.488 0.00 0.00 H+0 HETATM 87 H UNK 0 -2.378 1.597 3.402 0.00 0.00 H+0 HETATM 88 H UNK 0 -1.972 0.953 1.208 0.00 0.00 H+0 HETATM 89 H UNK 0 -3.645 1.106 -0.448 0.00 0.00 H+0 HETATM 90 H UNK 0 -5.466 2.744 1.381 0.00 0.00 H+0 HETATM 91 H UNK 0 -5.721 2.394 -0.321 0.00 0.00 H+0 HETATM 92 H UNK 0 -4.293 3.348 0.067 0.00 0.00 H+0 HETATM 93 H UNK 0 -4.207 -0.583 1.506 0.00 0.00 H+0 HETATM 94 H UNK 0 -6.272 -0.489 2.133 0.00 0.00 H+0 HETATM 95 H UNK 0 -6.612 -0.471 -0.304 0.00 0.00 H+0 HETATM 96 H UNK 0 -5.526 -1.777 0.120 0.00 0.00 H+0 CONECT 1 2 52 53 54 CONECT 2 1 3 50 CONECT 3 2 4 55 CONECT 4 3 5 56 57 CONECT 5 4 6 7 58 CONECT 6 5 59 CONECT 7 5 8 60 CONECT 8 7 9 61 CONECT 9 8 10 11 62 CONECT 10 9 63 64 65 CONECT 11 9 12 13 66 CONECT 12 11 67 CONECT 13 11 14 16 68 CONECT 14 13 15 69 70 CONECT 15 14 71 CONECT 16 13 17 72 CONECT 17 16 18 19 CONECT 18 17 73 74 75 CONECT 19 17 20 21 CONECT 20 19 CONECT 21 19 22 28 CONECT 22 21 23 24 CONECT 23 22 76 CONECT 24 22 25 26 CONECT 25 24 77 78 79 CONECT 26 24 27 80 CONECT 27 26 28 34 CONECT 28 27 29 21 CONECT 29 28 30 31 CONECT 30 29 CONECT 31 29 32 33 CONECT 32 31 CONECT 33 31 34 36 CONECT 34 33 35 27 CONECT 35 34 81 CONECT 36 33 37 82 CONECT 37 36 38 39 CONECT 38 37 CONECT 39 37 40 83 CONECT 40 39 41 84 CONECT 41 40 42 85 CONECT 42 41 43 86 CONECT 43 42 44 87 CONECT 44 43 45 88 CONECT 45 44 46 47 89 CONECT 46 45 90 91 92 CONECT 47 45 48 49 93 CONECT 48 47 94 CONECT 49 47 50 95 96 CONECT 50 49 51 2 CONECT 51 50 CONECT 52 1 CONECT 53 1 CONECT 54 1 CONECT 55 3 CONECT 56 4 CONECT 57 4 CONECT 58 5 CONECT 59 6 CONECT 60 7 CONECT 61 8 CONECT 62 9 CONECT 63 10 CONECT 64 10 CONECT 65 10 CONECT 66 11 CONECT 67 12 CONECT 68 13 CONECT 69 14 CONECT 70 14 CONECT 71 15 CONECT 72 16 CONECT 73 18 CONECT 74 18 CONECT 75 18 CONECT 76 23 CONECT 77 25 CONECT 78 25 CONECT 79 25 CONECT 80 26 CONECT 81 35 CONECT 82 36 CONECT 83 39 CONECT 84 40 CONECT 85 41 CONECT 86 42 CONECT 87 43 CONECT 88 44 CONECT 89 45 CONECT 90 46 CONECT 91 46 CONECT 92 46 CONECT 93 47 CONECT 94 48 CONECT 95 49 CONECT 96 49 MASTER 0 0 0 0 0 0 0 0 96 0 196 0 END SMILES for NP0001803 (Naphthomycin K)[H]OC1=C2N([H])C(=O)\C([H])=C(\[H])/C(/[H])=C(/[H])\C(\[H])=C([H])/[C@]([H])(C([H])([H])[H])[C@@]([H])(O[H])C([H])([H])C(=O)\C(=C([H])/C([H])([H])[C@]([H])(O[H])\C([H])=C([H])/[C@]([H])(C([H])([H])[H])[C@]([H])(O[H])[C@]([H])(\C([H])=C(/C(=O)C3=C(O[H])C(=C([H])C1=C3C(=O)C2=O)C([H])([H])[H])C([H])([H])[H])C([H])([H])O[H])C([H])([H])[H] INCHI for NP0001803 (Naphthomycin K)InChI=1S/C39H45NO11/c1-20-10-8-6-7-9-11-30(45)40-33-37(49)27-17-24(5)36(48)32(31(27)38(50)39(33)51)35(47)23(4)16-25(19-41)34(46)22(3)13-15-26(42)14-12-21(2)29(44)18-28(20)43/h6-13,15-17,20,22,25-26,28,34,41-43,46,48-49H,14,18-19H2,1-5H3,(H,40,45)/b7-6-,10-8-,11-9-,15-13-,21-12-,23-16-/t20-,22-,25+,26-,28-,34-/m0/s1 3D Structure for NP0001803 (Naphthomycin K) | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Synonyms | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Chemical Formula | C39H45NO11 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Average Mass | 703.7850 Da | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Monoisotopic Mass | 703.29926 Da | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
IUPAC Name | (7Z,9R,10S,11S,12Z,14S,16Z,20S,21S,22Z,24Z,26Z)-4,10,14,20,34-pentahydroxy-9-(hydroxymethyl)-3,7,11,17,21-pentamethyl-29-azatricyclo[28.3.1.0^{5,33}]tetratriaconta-1(33),2,4,7,12,16,22,24,26,30(34)-decaene-6,18,28,31,32-pentone | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Traditional Name | (7Z,9R,10S,11S,12Z,14S,16Z,20S,21S,22Z,24Z,26Z)-4,10,14,20,34-pentahydroxy-9-(hydroxymethyl)-3,7,11,17,21-pentamethyl-29-azatricyclo[28.3.1.0^{5,33}]tetratriaconta-1(33),2,4,7,12,16,22,24,26,30(34)-decaene-6,18,28,31,32-pentone | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
CAS Registry Number | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
SMILES | C[C@H]1\C=C/C=C\C=C/C(=O)NC2=C(O)C3=CC(C)=C(O)C(=C3C(=O)C2=O)C(=O)\C(C)=C/[C@H](CO)[C@@H](O)[C@@H](C)\C=C/[C@@H](O)C\C=C(C)/C(=O)C[C@@H]1O | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
InChI Identifier | InChI=1S/C39H45NO11/c1-20-10-8-6-7-9-11-30(45)40-33-37(49)27-17-24(5)36(48)32(31(27)38(50)39(33)51)35(47)23(4)16-25(19-41)34(46)22(3)13-15-26(42)14-12-21(2)29(44)18-28(20)43/h6-13,15-17,20,22,25-26,28,34,41-43,46,48-49H,14,18-19H2,1-5H3,(H,40,45)/b7-6-,10-8-,11-9-,15-13-,21-12-,23-16-/t20-,22-,25+,26-,28-,34-/m0/s1 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
InChI Key | NDPMXTPKMIGGDH-KAFVZXQCSA-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 | NPA011553 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
HMDB ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
DrugBank ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Phenol Explorer Compound ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
FoodDB ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
KNApSAcK ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Chemspider ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
KEGG Compound ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
BioCyc ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
BiGG ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Wikipedia Link | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
METLIN ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
PubChem Compound | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
PDB ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
ChEBI ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Good Scents ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
References | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
General References |
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