Mrv1652309092221482D 34 37 0 0 1 0 999 V2000 7.7104 -3.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7104 -2.5011 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9960 -2.0886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2815 -2.5011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4249 -2.0886 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4249 -1.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1394 -2.5011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8538 -2.0886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5683 -2.5011 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5683 -3.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2828 -2.0886 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.3690 -1.2682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1760 -1.0966 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5116 -0.3430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5885 -1.8111 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3955 -1.9826 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.1405 -1.1980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9475 -1.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7545 -1.5411 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.3065 -0.9280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0094 -2.3257 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.8164 -2.4972 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.3684 -1.8841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0713 -3.2818 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.8783 -3.4534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5193 -3.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7123 -3.7234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4574 -2.9388 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.9053 -3.5519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6504 -2.7673 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.0984 -3.3803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2914 -3.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0365 -2.4242 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.4234 -2.9762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 2 5 1 0 0 0 0 5 6 1 6 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 6 0 0 0 11 9 1 1 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 1 0 0 0 15 13 1 1 0 0 0 15 16 1 0 0 0 0 16 17 1 1 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 6 0 0 0 21 19 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 1 0 0 0 22 24 1 0 0 0 0 24 25 1 1 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 21 28 1 0 0 0 0 28 29 1 1 0 0 0 28 30 1 0 0 0 0 16 30 1 0 0 0 0 30 31 1 1 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 15 33 1 0 0 0 0 11 33 1 0 0 0 0 33 34 1 1 0 0 0 M END > NP0289557 > NP-MRD > C[C@H](CO)[C@H](C)CC[C@@H](C)[C@H]1C[C@@H](O)[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)CC[C@H](O)[C@H](O)[C@@H]3[C@@H](O)C[C@@]21O > InChI=1S/C28H50O6/c1-15(17(3)14-29)6-7-16(2)18-12-20(31)25-26(18,4)11-9-22-27(5)10-8-19(30)24(33)23(27)21(32)13-28(22,25)34/h15-25,29-34H,6-14H2,1-5H3/t15-,16-,17-,18-,19+,20-,21+,22-,23+,24+,25-,26-,27-,28+/m1/s1 > QLEHTNPUVWZOQF-ZNCSQDSCSA-N > C28H50O6 > 482.702 > 482.36073933 > 6 > 84 > 57.085124603645 > 1 > 6 > 0 > 0 > (1R,2S,5S,6R,7S,8S,10S,11S,12R,14R,15R)-14-[(2R,5R,6S)-7-hydroxy-5,6-dimethylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecane-5,6,8,10,12-pentol > 1.5273954736666673 > 1 > 4 > 0 > 14.112396505764188 > 13.519217075286996 > -1.618594009839275 > 121.38000000000001 > 132.0772 > 6 > 0 > (1R,2S,5S,6R,7S,8S,10S,11S,12R,14R,15R)-14-[(2R,5R,6S)-7-hydroxy-5,6-dimethylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecane-5,6,8,10,12-pentol > 0 > NP0289557 > (1r,3r,3as,3bs,5s,5as,6r,7s,9as,9br,11ar)-1-[(2r,5r,6s)-7-hydroxy-5,6-dimethylheptan-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-3,3b,5,6,7-pentol $$$$