SpectraBase Spectrum ID |
IqhRq42YdaL |
Name |
(3S,5S,8S,10S,13R,14S,17R)-17-[(1R,4R)-4-ethyl-1,5-dimethyl-hexyl]-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
Alternate Name(s) |
(3S,5S,8S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methyl-heptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
CAS Registry Number |
77794-81-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H50O |
InChI |
InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h15,19-26,30H,7-14,16-18H2,1-6H3/t20-,21-,22+,23+,24+,25-,26+,28+,29-/m1/s1 |
InChIKey |
VBAXUHSGNVJSAG-RJCKYEDGSA-N |
Molecular Weight |
414.718 g/mol |
SMILES |
O[C@]1(CC[C@@]2(C=3[C@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CC[C@](C(C)C)(CC)[H])(C)[H])[H])[H])(CC[C@]2(C1)[H])[H])C)[H] |
SPLASH |
splash10-03di-0053900000-8852ffacd7981c4bbe2e |
Source of Spectrum |
Va-0-0-0 |
Wiley ID |
740304 |