Preferred Name

chenodeoxycholic acid

Synonyms

Chenodeoxycholic acid

3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid

7alpha-hydroxylithocholic acid

chenic acid

anthropodesoxycholic acid

Chenodiol

3alpha,7alpha-Dihydroxy-5beta-cholanic acid

CDCA

anthropodeoxycholic acid

Chenix

gallodesoxycholic acid

Definitions

A dihydroxy-5beta-cholanic acid that is (5beta)-cholan-24-oic acid substituted by hydroxy groups at positions 3 and 7 respectively.

ID

http://purl.obolibrary.org/obo/CHEBI_16755

charge

0

database_cross_reference

LINCS:LSM-5353

Drug_Central:4361

HMDB:HMDB0000518

KEGG:C02528

PDBeChem:JN3

KEGG:D00163

PMID:24448653

PMID:16037564

Wikipedia:Chenodiol

PMID:24464484

PMID:11530998

Beilstein:3219887

CAS:474-25-9

DrugBank:DB06777

Reaxys:3219887

LIPID_MAPS_instance:LMST04010032

definition

A dihydroxy-5beta-cholanic acid that is (5beta)-cholan-24-oic acid substituted by hydroxy groups at positions 3 and 7 respectively.

formula

C24H40O4

has role

http://purl.obolibrary.org/obo/CHEBI_77746

http://purl.obolibrary.org/obo/CHEBI_75771

has_alternative_id

CHEBI:3593

CHEBI:3588

CHEBI:23094

has_exact_synonym

Chenodeoxycholic acid

3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid

has_obo_namespace

chebi_ontology

has_related_synonym

7alpha-hydroxylithocholic acid

chenic acid

anthropodesoxycholic acid

Chenodiol

3alpha,7alpha-Dihydroxy-5beta-cholanic acid

CDCA

anthropodeoxycholic acid

Chenix

gallodesoxycholic acid

id

CHEBI:16755

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

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

inchikey

RUDATBOHQWOJDD-BSWAIDMHSA-N

is conjugate acid of

http://purl.obolibrary.org/obo/CHEBI_36234

label

chenodeoxycholic acid

mass

392.57200

monoisotopicmass

392.29266

notation

CHEBI:16755

prefLabel

chenodeoxycholic acid

smiles

[H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])CC[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@H](O)C2)[C@H](C)CCC(O)=O

treeView

http://purl.obolibrary.org/obo/CHEBI_131620

http://purl.obolibrary.org/obo/CHEBI_3098

http://purl.obolibrary.org/obo/CHEBI_23775

subClassOf

http://purl.obolibrary.org/obo/CHEBI_131620

http://purl.obolibrary.org/obo/CHEBI_3098

http://purl.obolibrary.org/obo/CHEBI_23775

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Delete Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_16755 GO-PLUS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 DTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 SP SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 TXPO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 HINO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 MCO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 MAXO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_16755 GO-PLUS LOOM
http://purl.jp/bio/4/id/200906082665981390 IOBC LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/82490009 SNOMEDCT LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#2748 OCHV LOOM
http://purl.obolibrary.org/obo/ARO_3007538 ARO LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D002635 RH-MESH LOOM
http://purl.bioontology.org/ontology/SNMI/F-65160 SNMI LOOM
http://stirdf.jst.go.jp/id/200907074418421693 IOBC LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D04.808.221.430.342.300 RH-MESH LOOM
http://purl.obolibrary.org/obo/OMIT_0003960 OMIT LOOM
http://www.owl-ontologies.com/OntologyXCT.owl#ChenodeoxycholicAcid CTX LOOM
http://purl.obolibrary.org/obo/MESH_D002635 BERO LOOM
http://www.drugbank.ca/drugs/DB06777 FTC LOOM
http://purl.obolibrary.org/obo/dinto_DB06777 DINTO LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D04.808.105.225.272.150 RH-MESH LOOM
http://www.co-ode.org/ontologies/galen#ChenodeoxycholicAcid GALEN LOOM
http://purl.bioontology.org/ontology/RCD/XM0l5 RCD LOOM
https://go.drugbank.com/drugs/DB06777 MDM LOOM
http://purl.bioontology.org/ontology/MESH/D002635 MESH LOOM
http://purl.bioontology.org/ontology/RXNORM/2323 RXNORM LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 DTO LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 SP LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 TXPO LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 HINO LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 MCO LOOM
http://purl.obolibrary.org/obo/CHEBI_16755 MAXO LOOM
http://purl.bioontology.org/ontology/ATC/A05AA01 ATC LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000020371 NDFRT LOOM
http://www.phoc.org.cn/pmo/class/PMO_00018545 PMAPP-PMO LOOM
http://purl.bioontology.org/ontology/VANDF/4022365 VANDF LOOM