Mrv1652309122217422D 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 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 1 0 0 0 0 0 0 0 0 0 10.7559 -0.7161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1760 -1.0966 0.0000 C 0 0 2 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 2 0 0 0 0 0 0 0 0 0 13.6926 -0.5849 0.0000 O 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 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 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 6 0 0 0 10 8 1 1 0 0 0 10 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 0 0 0 0 13 14 1 6 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 6 0 0 0 18 20 1 0 0 0 0 20 21 1 6 0 0 0 20 22 1 0 0 0 0 22 23 1 1 0 0 0 23 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 22 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 10 33 1 0 0 0 0 33 34 1 1 0 0 0 M END > NP0330394 > NP-MRD > C[C@H](CO)CCC[C@@H](C)[C@H]1[C@@H](O)[C@H](O)[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)CC[C@H](O)C[C@@H]3[C@@H](O)[C@@H](O)[C@@]21O > InChI=1S/C27H48O7/c1-14(13-28)6-5-7-15(2)19-21(31)22(32)23-26(19,4)11-9-18-25(3)10-8-16(29)12-17(25)20(30)24(33)27(18,23)34/h14-24,28-34H,5-13H2,1-4H3/t14-,15+,16-,17+,18+,19-,20+,21+,22-,23+,24+,25-,26+,27-/m0/s1 > VHACFTUFOBCYNP-CDNXHFHWSA-N > C27H48O7 > 484.674 > 484.340003886 > 7 > 82 > 55.709715142528594 > 1 > 7 > 0 > 0 > (1R,2S,5S,7S,8R,9R,10S,11S,12R,13R,14R,15R)-14-[(2R,6S)-7-hydroxy-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecane-5,8,9,10,12,13-hexol > 0.5864786993333327 > 1 > 4 > 0 > 13.510945114217098 > 12.732111997686442 > -1.7410255746007204 > 141.61 > 128.6475 > 6 > 0 > (1R,2S,5S,7S,8R,9R,10S,11S,12R,13R,14R,15R)-14-[(2R,6S)-7-hydroxy-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecane-5,8,9,10,12,13-hexol > 0 > NP0330394 > (1r,2r,3r,3as,3bs,4r,5r,5as,7s,9as,9br,11ar)-1-[(2r,6s)-7-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-2,3,3b,4,5,7-hexol $$$$