| SpectraBase Spectrum ID |
7VYyXk9Ts0A |
| Name |
11.ALPHA.-HYDROXY-5.BETA.-PREGNAN-3,20-DIONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
332.235144887 u |
| Formula |
C21H32O3 |
| InChI |
InChI=1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13,15-19,24H,4-11H2,1-3H3/t13-,15+,16-,17+,18-,19-,20+,21-/m1/s1 |
| InChIKey |
XHCCPSKYYJBSAA-JMQWGRHHSA-N |
| Molecular Weight |
332.484 g/mol |
| Nominal Mass |
332 u |
| Number of Peaks |
148 |
| SMILES |
O[C@@]1(C[C@@]2([C@](CC[C@]2([C@@]2(CC[C@@]3(CC(CC[C@@]3([C@@]12[H])C)=O)[H])[H])[H])(C(C)=O)[H])C)[H] |
| SPLASH |
splash10-01vo-8912000000-053e7597642cb2574930 |
| Source File Reference |
LMCM-79781-343V |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
11-HYDROXYPREGNANE-3,20-DIONE
(5R,8S,9S,10S,11R,13S,14S,17S)-17-acetyl-11-hydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one |
| Wiley ID |
4_368 |
