| SpectraBase Spectrum ID |
8wmZDQVauAm |
| Name |
17.ALPHA.-HYDROXY-PREGNA-1,4-DIENE-3,20-DIONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
328.203844759 u |
| Formula |
C21H28O3 |
| InChI |
InChI=1S/C21H28O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h6,9,12,16-18,24H,4-5,7-8,10-11H2,1-3H3/t16-,17+,18+,19+,20+,21+/m1/s1 |
| InChIKey |
JQVUIHNKYYECGH-CEGNMAFCSA-N |
| Molecular Weight |
328.452 g/mol |
| Nominal Mass |
328 u |
| Number of Peaks |
88 |
| SMILES |
O[C@@]1(CC[C@]2([C@@]3(CCC4=CC(C=C[C@@]4([C@]3(CC[C@]12C)[H])C)=O)[H])[H])C(C)=O |
| SPLASH |
splash10-006x-7931000000-1187c278794a8e99b619 |
| Source File Reference |
LMCM-73181-275R |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
17-HYDROXYPREGNA-1,4-DIENE-3,20-DIONE
(8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-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_144 |
