| SpectraBase Spectrum ID |
L1py6cUgyjZ |
| Name |
11.BETA.,17.ALPHA.-DIHYDROXY-PREGNA-1,4-DIENE-3,20-DIONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
344.198759378 u |
| Formula |
C21H28O4 |
| InChI |
InChI=1S/C21H28O4/c1-12(22)21(25)9-7-16-15-5-4-13-10-14(23)6-8-19(13,2)18(15)17(24)11-20(16,21)3/h6,8,10,15-18,24-25H,4-5,7,9,11H2,1-3H3/t15-,16-,17-,18+,19-,20-,21-/m0/s1 |
| InChIKey |
KQZSMOGWYFPKCH-UJPCIWJBSA-N |
| Molecular Weight |
344.451 g/mol |
| Nominal Mass |
344 u |
| Number of Peaks |
74 |
| SMILES |
O[C@]1([C@]2(C[C@@]([C@@]3([C@]4(C=CC(C=C4CC[C@]3([C@@]2(CC1)[H])[H])=O)C)[H])(O)[H])C)C(C)=O |
| SPLASH |
splash10-006x-5921000000-ce4bb219884d3e553ad8 |
| Source File Reference |
LMCM-92310-277Y |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
11,17-DIHYDROXYPREGNA-1,4-DIENE-3,20-DIONE
(8S,9S,10R,11S,13S,14S,17R)-17-acetyl-11,17-dihydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one |
| Wiley ID |
4_147 |
