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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H32O2
Molecular Weight 292.4562
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANDROSTANE-3,17-DIOL, (3.ALPHA.,5.ALPHA.,17.ALPHA.)-

SMILES

C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC[C@]34C)[C@@H]1CC[C@H]2O

InChI

InChIKey=CBMYJHIOYJEBSB-CUZKMJQKSA-N
InChI=1S/C19H32O2/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/h12-17,20-21H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,17+,18-,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H32O2
Molecular Weight 292.4562
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:23:21 GMT 2025
Edited
by admin
on Mon Mar 31 23:23:21 GMT 2025
Record UNII
7M93TN23J9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3.ALPHA.,17.ALPHA.-DIHYDROXY-5.ALPHA.-ANDROSTANE
Preferred Name English
ANDROSTANE-3,17-DIOL, (3.ALPHA.,5.ALPHA.,17.ALPHA.)-
Systematic Name English
5.ALPHA.-ANDROSTANE-3.ALPHA.,17.ALPHA.-DIOL
Systematic Name English
5.ALPHA.-ANDROSTAN-3.ALPHA.,17.ALPHA.-DIOL
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID301312112
Created by admin on Mon Mar 31 23:23:21 GMT 2025 , Edited by admin on Mon Mar 31 23:23:21 GMT 2025
PRIMARY
FDA UNII
7M93TN23J9
Created by admin on Mon Mar 31 23:23:21 GMT 2025 , Edited by admin on Mon Mar 31 23:23:21 GMT 2025
PRIMARY
CAS
6165-21-5
Created by admin on Mon Mar 31 23:23:21 GMT 2025 , Edited by admin on Mon Mar 31 23:23:21 GMT 2025
PRIMARY
PUBCHEM
9857254
Created by admin on Mon Mar 31 23:23:21 GMT 2025 , Edited by admin on Mon Mar 31 23:23:21 GMT 2025
PRIMARY