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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H40O4
Molecular Weight 392.572
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CHENODIOL

SMILES

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

InChI

InChIKey=RUDATBOHQWOJDD-BSWAIDMHSA-N
InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H40O4
Molecular Weight 392.572
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Mar 06 10:26:19 UTC 2018
Edited
by admin
on Tue Mar 06 10:26:19 UTC 2018
Record UNII
0GEI24LG0J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CHENODIOL
MI   ORANGE BOOK   USAN   VANDF  
USAN  
Official Name English
3.ALPHA.,7.ALPHA.-DIHYDROXY-5.BETA.-CHOLAN-24-OIC ACID
Systematic Name English
CHENODEOXYCHOLIC ACID
EP   INN   MART.   VANDF   WHO-DD  
INN  
Official Name English
NSC-657949
Code English
CHENODEOXYCHOLIC ACID [MART.]
Common Name English
CHENODIOL [MI]
Common Name English
CHENODEOXYCHOLATE
Common Name English
CHENODIOL [USAN]
Common Name English
ANTHROPODESOXYCHOLIC ACID
Common Name English
CHENODEOXYCHOLIC ACID [EP]
Common Name English
CHENODIOL [VANDF]
Common Name English
CHOLANORM
Brand Name English
CHENODEOXYCHOLIC ACID [INN]
Common Name English
CHENOFALK
Brand Name English
CHENIX
Brand Name English
CHENOCOL
Brand Name English
CHENODEOXYCHOLIC ACID [VANDF]
Common Name English
CHENODIOL [ORANGE BOOK]
Common Name English
CHOLAN-24-OIC ACID, 3,7-DIHYDROXY-, (3.ALPHA.,5.BETA.,7.ALPHA.)
Common Name English
CHENODEOXYCHOLIC ACID [JAN]
Common Name English
CHENDOL
Brand Name English
GALLODESOXYCHOLIC ACID
Common Name English
FLUIBIL
Brand Name English
CHENOSSIL
Brand Name English
CHENODESOXYCHOLIC ACID
Common Name English
CHENIC ACID
Common Name English
ANTHROPODODESOXYCHOLIC ACID
Common Name English
ANTHROPODEOXYCHOLIC ACID
Common Name English
CHENODEOXYCHOLIC ACID [WHO-DD]
Common Name English
Classification Tree Code System Code
LIVERTOX 186
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
WHO-ATC A05AA01
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
WHO-VATC QA05AA01
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
Code System Code Type Description
CAS
474-25-9
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
IUPHAR
608
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
PUBCHEM
10133
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY SWITZERF
WIKIPEDIA
CHENODEOXYCHOLIC ACID
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
DRUG BANK
DB06777
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
ChEMBL
CHEMBL240597
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
MERCK INDEX
M3324
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY Merck Index
RXCUI
42588
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
ALTERNATIVE
MESH
D002635
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
INN
4391
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
EPA CompTox
474-25-9
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
EVMPD
SUB07463MIG
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
NCI_THESAURUS
C65206
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
ECHA (EC/EINECS)
207-481-8
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
RXCUI
2323
Created by admin on Tue Mar 06 10:26:19 UTC 2018 , Edited by admin on Tue Mar 06 10:26:19 UTC 2018
PRIMARY
Related Record Type Details
TRANSPORTER -> INHIBITOR
TRANSPORTER -> INHIBITOR
TARGET -> AGONIST
TARGET -> AGONIST
Related Record Type Details
PARENT -> METABOLITE
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Volume of Distribution PHARMACOKINETIC
Biological Half-life PHARMACOKINETIC