| SpectraBase Spectrum ID |
FsT3Bxfv0Cx |
| Name |
6.BETA.,11.ALPHA.-DIHYDROXY-PREGN-4-ENE-3,20-DIONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
346.214409442 u |
| Formula |
C21H30O4 |
| InChI |
InChI=1S/C21H30O4/c1-11(22)14-4-5-15-13-9-17(24)16-8-12(23)6-7-20(16,2)19(13)18(25)10-21(14,15)3/h8,13-15,17-19,24-25H,4-7,9-10H2,1-3H3/t13-,14+,15-,17+,18+,19+,20-,21+/m0/s1 |
| InChIKey |
KDHBHXVDYRGRDL-KDZLLLCRSA-N |
| Molecular Weight |
346.467 g/mol |
| Nominal Mass |
346 u |
| Number of Peaks |
96 |
| SMILES |
O[C@@]1(C[C@]2([C@@]3(CC[C@@]([C@]3(C[C@]([C@@]2([C@]2(CCC(C=C12)=O)C)[H])(O)[H])C)(C(C)=O)[H])[H])[H])[H] |
| SPLASH |
splash10-0007-9505000000-8f804ecfc85bb38627a2 |
| Source File Reference |
LMCM-95634-570W |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
6,11-DIHYDROXYPREGN-4-ENE-3,20-DIONE
(6R,8S,9S,10R,11R,13S,14S,17S)-17-acetyl-6,11-dihydroxy-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_295 |
