| SpectraBase Spectrum ID |
9v8xwhEK4AM |
| Name |
20.BETA.,21-DIHYDROXY-PREGN-4-ENE-3-ONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
332.235144887 u |
| Formula |
C21H32O3 |
| InChI |
InChI=1S/C21H32O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h11,15-19,22,24H,3-10,12H2,1-2H3/t15-,16-,17-,18+,19-,20-,21-/m0/s1 |
| InChIKey |
ZCFUAGVJMSGCHS-UJPCIWJBSA-N |
| Molecular Weight |
332.484 g/mol |
| Nominal Mass |
332 u |
| Number of Peaks |
115 |
| SMILES |
OC[C@@]([C@]1(CC[C@]2([C@@]3(CCC4=CC(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=O)[H])[H])[H])(O)[H] |
| SPLASH |
splash10-0fl0-5923000000-0d134d894094c6f92418 |
| Source File Reference |
LMCM-33966-086R |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
20,21-DIHYDROXYPREGN-4-EN-3-ONE
(8S,9S,10R,13S,14S,17S)-17-((R)-1,2-dihydroxyethyl)-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one |
| Wiley ID |
4_319 |
