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 ETIOCHOLANEDIOL

SMILES

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

InChI

InChIKey=CBMYJHIOYJEBSB-GCXXXECGSA-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+/m1/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 Sat Dec 16 10:12:45 GMT 2023
Edited
by admin
on Sat Dec 16 10:12:45 GMT 2023
Record UNII
D8A379RX68
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETIOCHOLANEDIOL
Common Name English
(3.ALPHA.,5.BETA.,17.BETA.)-ANDROSTANE-3,17-DIOL
Systematic Name English
3.ALPHA.,17.BETA.-DIHYDROXYETIOCHOLANE
Systematic Name English
5.BETA.-ANDROSTANE-3.ALPHA.,17.BETA.-DIOL
Systematic Name English
ANDROSTANE-3,17-DIOL, (3.ALPHA.,5.BETA.,17.BETA.)-
Systematic Name English
.BETA.-ANDROSTANE-3.ALPHA.,17.BETA.-DIOL
Systematic Name English
Code System Code Type Description
CAS
1851-23-6
Created by admin on Sat Dec 16 10:12:45 GMT 2023 , Edited by admin on Sat Dec 16 10:12:45 GMT 2023
PRIMARY
PUBCHEM
134494
Created by admin on Sat Dec 16 10:12:45 GMT 2023 , Edited by admin on Sat Dec 16 10:12:45 GMT 2023
PRIMARY
EPA CompTox
DTXSID101017857
Created by admin on Sat Dec 16 10:12:45 GMT 2023 , Edited by admin on Sat Dec 16 10:12:45 GMT 2023
PRIMARY
FDA UNII
D8A379RX68
Created by admin on Sat Dec 16 10:12:45 GMT 2023 , Edited by admin on Sat Dec 16 10:12:45 GMT 2023
PRIMARY
WIKIPEDIA
3α-Etiocholanediol
Created by admin on Sat Dec 16 10:12:45 GMT 2023 , Edited by admin on Sat Dec 16 10:12:45 GMT 2023
PRIMARY