| SpectraBase Spectrum ID |
EIVpis23bq0 |
| Name |
[(1R)-1-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethyl] acetate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H32O3 |
| InChI |
InChI=1S/C23H32O3/c1-14(26-15(2)24)19-7-8-20-18-6-5-16-13-17(25)9-11-22(16,3)21(18)10-12-23(19,20)4/h9,11,13-14,18-21H,5-8,10,12H2,1-4H3/t14-,18+,19-,20+,21+,22+,23-/m1/s1 |
| InChIKey |
PDVBJOFBNYIZJE-KZJFZMNRSA-N |
| Instrument Name |
Micromass Autospec |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np1007608 |
| Molecular Weight |
356.506 g/mol |
| Optical Rotation |
[a]D20 = +39.3 (c = 0.28, CH2Cl2) |
| Reported Formula |
C23H32O3 |
| SMILES |
C1=C[C@]2(C(=CC1=O)CC[C@@]1([C@@]2(CC[C@]2([C@]1(CC[C@]2([H])[C@](OC(=O)C)(C)[H])[H])C)[H])[H])C |
| SPLASH |
splash10-00di-3910000000-de490627a7f3b15e3568 |
| Source of Spectrum |
G4-74-295-2 |
| Wiley ID |
1849053 |
![[(1R)-1-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethyl] acetate](/api/spectrum/EIVpis23bq0/structure.png?h=300&w=458 "[(1R)-1-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethyl] acetate")
