SpectraBase Spectrum ID |
A8crsvQTVKM |
Name |
(8R,9S,10S,13S,14S)-17-acetyl-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H32O2 |
InChI |
InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14,16-19H,4-12H2,1-3H3/t14?,16-,17?,18-,19-,20-,21+/m0/s1 |
InChIKey |
XMRPGKVKISIQBV-JSCJIGOASA-N |
Molecular Weight |
316.485 g/mol |
SMILES |
C1C(CC2[C@](C1)([C@@]1([C@@](CC2)([C@]2([C@](CC1)(C(CC2)C(C)=O)C)[H])[H])[H])C)=O |
SPLASH |
splash10-000x-9640000000-b5e8ad687734fee8f886 |
Source of Spectrum |
Fu-Qiang Peng, et al. Chemosphere, V.95, 2014, P.581-588 |
Synonyms |
(8R,9S,10S,13S,14S)-17-acetyl-10,13-dimethylhexadecahydro-3H-cyclopenta[a]phenanthren-3-one |
Wiley ID |
1817360 |