| SpectraBase Spectrum ID |
1cZs5Wvlgm |
| Name |
3.BETA.,20.ALPHA.-DIHYDROXY-PREGN-5-ENE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
318.255880333 u |
| Formula |
C21H34O2 |
| InChI |
InChI=1S/C21H34O2/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/h4,13,15-19,22-23H,5-12H2,1-3H3/t13-,15-,16-,17+,18-,19-,20-,21+/m0/s1 |
| InChIKey |
QAAQQTDJEXMIMF-YZXCLFAISA-N |
| Molecular Weight |
318.501 g/mol |
| Nominal Mass |
318 u |
| Number of Peaks |
150 |
| SMILES |
O[C@]([C@@]1([C@]2(CC[C@@]3([C@]4(CC[C@@](CC4=CC[C@]3([C@@]2(CC1)[H])[H])(O)[H])C)[H])C)[H])(C)[H] |
| SPLASH |
splash10-0aos-6932000000-5decfb2b65057f7ade0b |
| Source File Reference |
LMCM-73878-536P |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
PREGN-5-ENE-3,20-DIOL
(3S,8S,9S,10R,13S,14S,17S)-17-((S)-1-hydroxyethyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Wiley ID |
4_380 |
