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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H28O2
Molecular Weight 300.4351
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of A-Norandrostan-17-one, 2-ethynyl-2-hydroxy-, (2?,5?)-

SMILES

C[C@]12C[C@](O)(C[C@@H]1CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@H]23)C#C

InChI

InChIKey=MNEYCBHWSMBXJI-IMDGIPCPSA-N
InChI=1S/C20H28O2/c1-4-20(22)11-13-5-6-14-15-7-8-17(21)18(15,2)10-9-16(14)19(13,3)12-20/h1,13-16,22H,5-12H2,2-3H3/t13-,14-,15-,16-,18-,19-,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H28O2
Molecular Weight 300.4351
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:14:50 GMT 2025
Edited
by admin
on Mon Mar 31 22:14:50 GMT 2025
Record UNII
EE4QT74ZLA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
A-Norandrostan-17-one, 2-ethynyl-2-hydroxy-, (2?,5?)-
Common Name English
A-NOR-5-ALPHA-ANDROSTAN-17-BETA-ONE, 2-ALPHA-ETHYNYL-2-BETA-HYDROXY-
Preferred Name English
(3aS,3bR,5aS,7R,8aS,8bS,10aS)-7-Ethynyltetradecahydro-7-hydroxy-8a,10a-dimethyldicyclopenta[a,f]naphthalen-1(2H)-one
Systematic Name English
Dicyclopenta[a,f]naphthalen-1(2H)-one, 7-ethynyltetradecahydro-7-hydroxy-8a,10a-dimethyl-, (3aS,3bR,5aS,7R,8aS,8bS,10aS)-
Systematic Name English
A-Nor-5?-androstan-17-one, 2?-ethynyl-2-hydroxy-
Common Name English
Code System Code Type Description
CAS
1038-22-8
Created by admin on Mon Mar 31 22:14:50 GMT 2025 , Edited by admin on Mon Mar 31 22:14:50 GMT 2025
PRIMARY
FDA UNII
EE4QT74ZLA
Created by admin on Mon Mar 31 22:14:50 GMT 2025 , Edited by admin on Mon Mar 31 22:14:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID50908603
Created by admin on Mon Mar 31 22:14:50 GMT 2025 , Edited by admin on Mon Mar 31 22:14:50 GMT 2025
PRIMARY
PUBCHEM
101699642
Created by admin on Mon Mar 31 22:14:50 GMT 2025 , Edited by admin on Mon Mar 31 22:14:50 GMT 2025
PRIMARY