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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H38O3
Molecular Weight 374.5567
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LITHOCHOLENIC ACID

SMILES

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

InChI

InChIKey=FEGCPHIPSRBREU-HVATVPOCSA-N
InChI=1S/C24H38O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h11,13,15-21,25H,4-10,12,14H2,1-3H3,(H,26,27)/t15-,16-,17-,18+,19-,20+,21+,23+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H38O3
Molecular Weight 374.5567
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:17:05 GMT 2023
Edited
by admin
on Sat Dec 16 10:17:05 GMT 2023
Record UNII
BAO73Q70IY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LITHOCHOLENIC ACID
Common Name English
3ALPHA-HYDROXY-5BETA-CHOL-11-EN-24-OIC ACID
Systematic Name English
11-CHOLENIC ACID, 3.ALPHA.-HYDROXY-
Systematic Name English
CHOL-11-EN-24-OIC ACID, 3-HYDROXY-, (3.ALPHA.,5.BETA.)-
Systematic Name English
3.ALPHA.-HYDROXY-5.BETA.-CHOL-11-EN-24-OIC ACID
Systematic Name English
Code System Code Type Description
CAS
1053-37-8
Created by admin on Sat Dec 16 10:17:05 GMT 2023 , Edited by admin on Sat Dec 16 10:17:05 GMT 2023
PRIMARY
FDA UNII
BAO73Q70IY
Created by admin on Sat Dec 16 10:17:05 GMT 2023 , Edited by admin on Sat Dec 16 10:17:05 GMT 2023
PRIMARY
PUBCHEM
5283972
Created by admin on Sat Dec 16 10:17:05 GMT 2023 , Edited by admin on Sat Dec 16 10:17:05 GMT 2023
PRIMARY