U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H28O3
Molecular Weight 304.4238
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3.BETA.-HYDROXY-5.ALPHA.-ANDROSTANE-7,17-DIONE

SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)C(=O)C[C@H]4C[C@@H](O)CC[C@]34C

InChI

InChIKey=ONVVZSHYQMOXLN-ZVMDJWLLSA-N
InChI=1S/C19H28O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h11-14,17,20H,3-10H2,1-2H3/t11-,12+,13+,14+,17+,18+,19+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-37849
Preferred Name English
3.BETA.-HYDROXY-5.ALPHA.-ANDROSTANE-7,17-DIONE
Systematic Name English
ANDROSTANE-7,17-DIONE, 3-HYDROXY-, (3.BETA.,5.ALPHA.)-
Systematic Name English
5.ALPHA.-ANDROSTANE-7,17-DIONE, 3.BETA.-HYDROXY-
Systematic Name English
Code System Code Type Description
FDA UNII
4P27C9PV5C
Created by admin on Mon Mar 31 22:20:56 GMT 2025 , Edited by admin on Mon Mar 31 22:20:56 GMT 2025
PRIMARY
CAS
49643-99-4
Created by admin on Mon Mar 31 22:20:56 GMT 2025 , Edited by admin on Mon Mar 31 22:20:56 GMT 2025
PRIMARY
NSC
37849
Created by admin on Mon Mar 31 22:20:56 GMT 2025 , Edited by admin on Mon Mar 31 22:20:56 GMT 2025
PRIMARY
PUBCHEM
11954160
Created by admin on Mon Mar 31 22:20:56 GMT 2025 , Edited by admin on Mon Mar 31 22:20:56 GMT 2025
PRIMARY