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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H30O3
Molecular Weight 306.4397
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 11.BETA.-HYDROXYETIOCHOLANOLONE

SMILES

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

InChI

InChIKey=PIXFHVWJOVNKQK-DLAZEALESA-N
InChI=1S/C19H30O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h11-15,17,20-21H,3-10H2,1-2H3/t11-,12-,13+,14+,15+,17-,18+,19+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
11.BETA.-HYDROXYETIOCHOLANOLONE
Common Name English
BA-2686
Preferred Name English
11.BETA.-OH-ETIOCHOLANOLONE
Common Name English
11.BETA.-HYDROXYAETIOCHOLANOLONE
Common Name English
3.ALPHA.,11.BETA.-DIHYDROXYETIOCHOLAN-17-ONE
Systematic Name English
ANDROSTAN-17-ONE, 3,11-DIHYDROXY-, (3.ALPHA.,5.BETA.,11.BETA.)-
Systematic Name English
NSC-53897
Code English
5.BETA.-ANDROSTANE-3.ALPHA.,11.BETA.-DIOL-17-ONE
Systematic Name English
5.BETA.-ANDROSTAN-3.ALPHA.,11.BETA.-DIOL-17-ONE
Common Name English
3.ALPHA.,11.BETA.-DIHYDROXY-5.BETA.-ANDROSTANE-17-ONE
Systematic Name English
(3.ALPHA.,5.BETA.,11.BETA.)-3,11-DIHYDROXYANDROSTAN-17-ONE
Systematic Name English
3.ALPHA.,11.BETA.-DIHYDROXY-5.BETA.-ANDROSTAN-17-ONE
Systematic Name English
Code System Code Type Description
CAS
739-26-4
Created by admin on Tue Apr 01 16:22:16 GMT 2025 , Edited by admin on Tue Apr 01 16:22:16 GMT 2025
PRIMARY
NSC
53897
Created by admin on Tue Apr 01 16:22:16 GMT 2025 , Edited by admin on Tue Apr 01 16:22:16 GMT 2025
PRIMARY
EPA CompTox
DTXSID70861589
Created by admin on Tue Apr 01 16:22:16 GMT 2025 , Edited by admin on Tue Apr 01 16:22:16 GMT 2025
PRIMARY
PUBCHEM
101849
Created by admin on Tue Apr 01 16:22:16 GMT 2025 , Edited by admin on Tue Apr 01 16:22:16 GMT 2025
PRIMARY
FDA UNII
74B865164G
Created by admin on Tue Apr 01 16:22:16 GMT 2025 , Edited by admin on Tue Apr 01 16:22:16 GMT 2025
PRIMARY