15481847 CDK 0521212310 32 35 0 0 0 0 0 0 0 0999 V2000 2.0920 -2.7973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5413 -0.2792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5413 -1.1042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8269 -1.5167 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1124 -1.1042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3219 -0.0278 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8269 0.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3616 -1.5223 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3219 -1.3556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1124 -0.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8034 -0.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8401 -2.3759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5413 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -2.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5783 0.7564 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5969 -1.0570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0992 -2.8113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -0.6974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5832 -2.8352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8149 -1.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8081 -2.3877 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0273 1.3705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3855 0.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6419 1.7107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4491 1.8808 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7054 2.6650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0001 1.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5126 2.8352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6156 -1.8015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4369 -1.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7197 -0.7536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0148 0.0810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21 1 1 1 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 13 1 1 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 29 1 6 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 30 1 1 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 5 31 1 6 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 6 32 1 6 0 0 0 7 10 1 0 0 0 0 8 14 1 0 0 0 0 8 16 1 0 0 0 0 8 18 1 1 0 0 0 9 11 1 0 0 0 0 12 17 1 0 0 0 0 14 17 2 0 0 0 0 14 19 1 0 0 0 0 15 22 1 6 0 0 0 15 23 1 0 0 0 0 16 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 6 0 0 0 26 28 1 0 0 0 0 M END > CHEBI:173008 > 27-nor-(24S)-methylcholest-5,22E-dien-3beta-ol > 2 > (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,2R,5S)-5-methylhept-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol > C27H44O > 384.648 > 384.33922 > 0 > O[C@@H]1CC=2[C@@]([C@@]3([C@]([C@]4([C@@]([C@](CC4)([C@H](C)/C=C/[C@H](CC)C)[H])(CC3)C)[H])(CC2)[H])[H])(CC1)C > InChI=1S/C27H44O/c1-6-18(2)7-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7-9,18-19,21-25,28H,6,10-17H2,1-5H3/b8-7+/t18-,19+,21-,22-,23+,24-,25-,26-,27+/m0/s1 > UBEHHDQAQBJTAE-QWGBUROSSA-N > LMST01031049 $$$$