3081996 CDK 1106202311 32 35 0 0 0 0 0 0 0 0999 V2000 1.6500 -3.0193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0993 -0.5011 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0993 -1.3261 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3849 -1.7386 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8799 -0.2497 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6703 -1.3261 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3849 -0.0886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8799 -1.5776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3614 -0.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6703 -0.5011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9196 -1.7443 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3981 -2.5978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1363 0.5344 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0993 0.3239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6572 -3.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -2.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -1.2789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9435 0.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5852 1.1485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3729 -1.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1413 -3.0571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1998 1.4888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3661 -2.6096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0070 1.6589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2633 2.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0706 2.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7124 3.0571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1735 -2.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9948 -2.0845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5727 -0.1409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2777 -0.9755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9331 -1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 7 1 0 0 0 0 2 14 1 1 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 28 1 6 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 4 29 1 1 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 5 30 1 6 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 31 1 6 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 11 32 1 1 0 0 0 12 15 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 6 0 0 0 15 16 1 0 0 0 0 16 21 2 0 0 0 0 17 20 1 0 0 0 0 18 22 1 0 0 0 0 20 23 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M END > CHEBI:166788 > 19-Norcholestenone > 2 > (8R,9S,10R,13R,14S,17R)-13-methyl-17-[(2R)-6-methylheptan-2-yl]-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one > C26H42O > 370.621 > 370.32357 > 0 > O=C1CC[C@@]2([C@@]3([C@]([C@]4([C@@]([C@](CC4)([C@@H](CCCC(C)C)C)[H])(CC3)C)[H])(CCC2=C1)[H])[H])[H] > InChI=1S/C26H42O/c1-17(2)6-5-7-18(3)24-12-13-25-23-10-8-19-16-20(27)9-11-21(19)22(23)14-15-26(24,25)4/h16-18,21-25H,5-15H2,1-4H3/t18-,21+,22-,23-,24-,25+,26-/m1/s1 > GJQWMFNAGHAFDW-DNHZKMRASA-N > 3404-22-6 > 3404-22-6 > LMST01010313 $$$$