SpectraBase Spectrum ID |
GokFPgn3poM |
Name |
(1R,5R,8S,9S,10S,13R,14S,17R)-1,10,13-trimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one |
Alternate Name(s) |
(1R,5R,8S,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-1,10,13-trimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H48O |
InChI |
InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)24-12-13-25-23-11-10-21-17-22(29)16-20(4)28(21,6)26(23)14-15-27(24,25)5/h18-21,23-26H,7-17H2,1-6H3/t19-,20-,21-,23+,24-,25+,26+,27-,28+/m1/s1 |
InChIKey |
ISADDWKEOLGOGP-HCNFZKCESA-N |
Molecular Weight |
400.691 g/mol |
SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC[C@@]2(CC(C[C@]1(C)[H])=O)[H])[H])C |
SPLASH |
splash10-0aos-6916500000-d3ba839b57e38def1be6 |
Source of Spectrum |
KC-1992-3108-12 |
Wiley ID |
777379 |