| SpectraBase Spectrum ID |
ANzkkU3QlTt |
| Name |
(4R)-4-[(9S,10R,13R,14R,17R)-10,13-dimethyl-3-oxo-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H34O3 |
| InChI |
InChI=1S/C25H34O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h7,11,13,15-16,20-22H,5-6,8-10,12,14H2,1-4H3/t16-,20-,21+,22+,24+,25-/m1/s1 |
| InChIKey |
IQAQSCUDYAFRSF-HZDMZQDYSA-N |
| Molecular Weight |
382.544 g/mol |
| SMILES |
C=12[C@]3([C@]([C@@]([C@@](CCC(=O)OC)(C)[H])(CC3)[H])(C)CC[C@@]2([C@]2(C=CC(C=C2CC1)=O)C)[H])[H] |
| SPLASH |
splash10-001i-0493000000-dfee4fa20ff39994526f |
| Source of Spectrum |
F-49-2494-17 |
| Synonyms |
(4R)-4-[(9S,10R,13R,14R,17R)-3-keto-10,13-dimethyl-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]valeric acid methyl ester
Methyl (4R)-4-[(9S,10R,13R,14R,17R)-10,13-dimethyl-3-oxidanylidene-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pentanoate
Methyl (4R)-4-[(9S,10R,13R,14R,17R)-10,13-dimethyl-3-oxo-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pentanoate |
| Wiley ID |
1360820 |
![(4R)-4-[(9S,10R,13R,14R,17R)-10,13-dimethyl-3-oxo-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester](/api/spectrum/ANzkkU3QlTt/structure.png?h=300&w=458 "(4R)-4-[(9S,10R,13R,14R,17R)-10,13-dimethyl-3-oxo-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester")
