| SpectraBase Spectrum ID |
AzOUj7DNHPs |
| Name |
17.BETA.-HYDROXY-5.ALPHA.,17.ALPHA.-PREGNAN-3-ONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
318.255880333 u |
| Formula |
C21H34O2 |
| InChI |
InChI=1S/C21H34O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h14,16-18,23H,4-13H2,1-3H3/t14-,16+,17-,18-,19-,20-,21-/m0/s1 |
| InChIKey |
GPUVTXKHQDYRQO-JJFNZWTKSA-N |
| Molecular Weight |
318.501 g/mol |
| Nominal Mass |
318 u |
| Number of Peaks |
97 |
| SMILES |
O[C@]1(CC[C@]2([C@@]3(CC[C@]4(CC(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=O)[H])[H])[H])CC |
| SPLASH |
splash10-052r-9671000000-0d8331f077945ed2a2aa |
| Source File Reference |
LMCM-93109-108K |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
17-.BETA.HYDROXY-5.ALPHA.-PREGNAN-3-ONE
17-HYDROXYPREGNAN-3-ONE
(5S,8R,9S,10S,13S,14S,17S)-17-ethyl-17-hydroxy-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one |
| Wiley ID |
4_264 |
