| SpectraBase Spectrum ID |
AcbsZkU6Xt |
| Name |
(3R,5R,6S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,2R,5S)-6-methyl-5-(trifluoromethyl)hept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H45F3O2 |
| InChI |
InChI=1S/C28H45F3O2/c1-16(2)20(28(29,30)31)7-6-17(3)21-8-9-22-19-15-25(33)24-14-18(32)10-12-27(24,5)23(19)11-13-26(21,22)4/h6-7,16-25,32-33H,8-15H2,1-5H3/b7-6+/t17-,18-,19+,20-,21-,22+,23+,24+,25+,26-,27-/m1/s1 |
| InChIKey |
SFECPSJMDNVPHR-HJMPPJPGSA-N |
| Molecular Weight |
470.661 g/mol |
| SMILES |
O[C@]1(C[C@@]2([C@@]([C@@]3([C@@](C[C@@]2(O)[H])([C@@]2(CC[C@@]([C@]2(CC3)C)([C@@](\C=C\[C@@](C(F)(F)F)(C(C)C)[H])(C)[H])[H])[H])[H])[H])(CC1)C)[H])[H] |
| SPLASH |
splash10-0a4i-0090200000-07041a1851498b5ce55c |
| Source of Spectrum |
J-65-6236-16 |
| Synonyms |
(3R,5R,6S,8S,9S,10R,13R,14S,17R)-17-[(E,1R,4S)-1,5-dimethyl-4-(trifluoromethyl)hex-2-enyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6-diol |
| Wiley ID |
1533196 |
![(3R,5R,6S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,2R,5S)-6-methyl-5-(trifluoromethyl)hept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6-diol](/api/spectrum/AcbsZkU6Xt/structure.png?h=300&w=458 "(3R,5R,6S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,2R,5S)-6-methyl-5-(trifluoromethyl)hept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6-diol")
