| SpectraBase Spectrum ID |
ChqReQrrSRC |
| Name |
Androsterone |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
53-41-8 |
| ChEBI ID |
16032 |
| Comments |
Saturated androsterone - Sigma-Aldrich; Solvent acetone; pH , temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C19 H30 O2 |
| IUPAC Name |
(3R,5S,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one |
| InChI |
InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18-,19-/m0/s1 |
| InChIKey |
QGXBDMJGAMFCBF-HLUDHZFRSA-N |
| KEGG Compound ID |
C00523 |
| KEGG Pathways |
PATH: ko00150 Androgen and estrogen metabolism |
| PubChem Compound ID |
5879 |
| SMILES |
CC12CCC(CC1CCC3C2CCC4(C3CCC4=O)C)O |
| Source File Reference |
bmse000543 |
