Mrv1533004241513132D 61 66 0 0 0 0 999 V2000 -2.2261 -4.6434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4089 -4.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -5.5204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9025 -4.1049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0853 -4.2178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -5.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0276 -3.4005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -4.3306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2383 -3.6793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0556 -3.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3665 -4.5563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5619 -3.1408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2132 -3.6472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9106 -2.6345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0683 -2.4895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 -1.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -1.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5218 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1731 -1.7404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3708 -0.9394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9853 -1.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2655 -0.8192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0777 -0.6740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6095 -1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4216 -1.1595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7019 -0.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9534 -1.7902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7655 -1.6450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6731 -2.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2049 -3.1969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9246 -3.9728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4565 -4.6035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1762 -5.3794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7080 -6.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5201 -5.8649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0519 -6.4956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8640 -6.3504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3959 -6.9811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2080 -6.8359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7398 -7.4666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1156 -7.7570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6474 -8.3877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3034 -7.9022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0231 -8.6782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7716 -7.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9595 -7.4168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3640 -5.5246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0838 -6.3006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8322 -4.8939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 -5.0391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1125 -4.1180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5807 -3.4873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8610 -2.7114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3292 -2.0807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5171 -2.2259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0489 -2.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2368 -3.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7686 -3.6325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4247 -3.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8928 -2.5163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -3.2587 0.0000 C 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 2 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 5 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 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 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 38 41 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 36 45 1 0 0 0 0 45 46 1 0 0 0 0 33 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 49 51 1 0 0 0 0 31 51 1 0 0 0 0 51 52 1 0 0 0 0 29 53 1 0 0 0 0 53 54 2 0 0 0 0 24 54 1 0 0 0 0 54 55 1 0 0 0 0 21 55 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 57 58 2 0 0 0 0 57 59 1 0 0 0 0 59 60 1 0 0 0 0 15 60 1 0 0 0 0 19 60 1 0 0 0 0 60 61 1 0 0 0 0 M END > NP0272245 > NP-MRD > CC(=O)OC(C)(C)CCC(O)C(C)(O)C1C(O)CC2(C)C3CCC4=C(C)C(O)=C(OC5OC(COC6OC(CO)C(O)C(O)C6O)C(O)C(O)C5O)C=C4C3(C)C(=O)CC12C > InChI=1S/C43H66O18/c1-18-20-9-10-26-40(5)14-22(46)36(43(8,56)27(47)11-12-39(3,4)61-19(2)45)41(40,6)15-28(48)42(26,7)21(20)13-23(29(18)49)58-38-35(55)33(53)31(51)25(60-38)17-57-37-34(54)32(52)30(50)24(16-44)59-37/h13,22,24-27,30-38,44,46-47,49-56H,9-12,14-17H2,1-8H3 > XLJZVUSWNGLRKV-UHFFFAOYSA-N > C43H66O18 > 870.983 > 870.424915285 > 17 > 127 > 91.41777611802922 > 0 > 11 > 0 > 0 > 6-(5,13-dihydroxy-1,6,11,15-tetramethyl-17-oxo-4-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-2,4,6-trien-14-yl)-5,6-dihydroxy-2-methylheptan-2-yl acetate > 0.86 > -0.6012856900000024 > -3.01 > 1 > 6 > 0 > 11.906468420304195 > 10.228786318467382 > -3.347848677630555 > 302.82 > 211.86510000000004 > 13 > 0 > 8.44e-01 g/l > 6-(5,13-dihydroxy-1,6,11,15-tetramethyl-17-oxo-4-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-2,4,6-trien-14-yl)-5,6-dihydroxy-2-methylheptan-2-yl acetate > 0 > NP0272245 > 6-(2,7-dihydroxy-3a,6,9b,11a-tetramethyl-10-oxo-8-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1h,2h,3h,3bh,4h,5h,11h-cyclopenta[a]phenanthren-1-yl)-5,6-dihydroxy-2-methylheptan-2-yl acetate $$$$