| SpectraBase Spectrum ID |
Gw2zlMIwrY7 |
| Name |
Androstane-16-carboxylic acid, 3-hydroxy-17-oxo-, methyl ester, (3.beta.,5.alpha.)- |
| CAS Registry Number |
13542-28-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O4 |
| InChI |
InChI=1S/C21H32O4/c1-20-8-6-13(22)10-12(20)4-5-14-16(20)7-9-21(2)17(14)11-15(18(21)23)19(24)25-3/h12-17,22H,4-11H2,1-3H3/t12-,13-,14+,15?,16-,17-,20-,21-/m0/s1 |
| InChIKey |
VLTVQWBXFDKJJZ-WJGVYPSRSA-N |
| Molecular Weight |
348.483 g/mol |
| SMILES |
O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(C1)[H])[H])(CC(C4=O)C(=O)OC)[H])C)[H])C)[H] |
| SPLASH |
splash10-0a4i-0921000000-6c728613ce828dc07169 |
| Source of Spectrum |
B-33-118-0 |
| Synonyms |
5.alpha.-androstane-16-carboxylic acid, 3.beta.-hydroxy-17-oxo-, methyl ester
Methyl (3beta,5alpha)-3-hydroxy-17-oxoandrostane-16-carboxylate
Methyl 3.beta.-hydroxy-17-oxo-5.alpha.-androstane-16-carboxylate |
| Wiley ID |
1340836 |
