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The Prescription of Drugs Ontology
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September 4, 2020
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| Id | http://purl.obolibrary.org/obo/CHEBI_16755
http://purl.obolibrary.org/obo/CHEBI_16755
|
|---|---|
| Preferred Name | chenodeoxycholic acid |
| Definitions |
A dihydroxy-5beta-cholanic acid that is (5beta)-cholan-24-oic acid substituted by hydroxy groups at positions 3 and 7 respectively.
|
| Synonyms |
anthropodesoxycholic acid
7alpha-hydroxylithocholic acid
3alpha,7alpha-Dihydroxy-5beta-cholanic acid
chenic acid
gallodesoxycholic acid
anthropodeoxycholic acid
CDCA
Chenix
Chenodiol
3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid
Chenodeoxycholic acid
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|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| label |
chenodeoxycholic acid
|
|---|---|
| prefLabel |
chenodeoxycholic acid
|
| database_cross_reference |
Beilstein:3219887
PMID:24448653
PMID:16037564
CAS:474-25-9
LIPID_MAPS_instance:LMST04010032
PMID:11530998
HMDB:HMDB0000518
Wikipedia:Chenodiol
Drug_Central:4361
KEGG:D00163
PMID:24464484
KEGG:C02528
PDBeChem:JN3
DrugBank:DB06777
LINCS:LSM-5353
Reaxys:3219887
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|
| notation |
CHEBI:16755
|
| in_subset | |
| 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
|
| has_related_synonym |
anthropodesoxycholic acid
7alpha-hydroxylithocholic acid
3alpha,7alpha-Dihydroxy-5beta-cholanic acid
chenic acid
gallodesoxycholic acid
anthropodeoxycholic acid
CDCA
Chenix
Chenodiol
See more
See less
|
| id |
CHEBI:16755
|
| charge |
0
|
| has_obo_namespace |
chebi_ontology
|
| textual 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
|
| subClassOf | |
| inchikey |
RUDATBOHQWOJDD-BSWAIDMHSA-N
|
| mass |
392.57200
|
| monoisotopicmass |
392.29266
|
| has_alternative_id |
CHEBI:23094
CHEBI:3588
CHEBI:3593
|
| type | |
| 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
|
| has role | |
| has_exact_synonym |
3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid
Chenodeoxycholic acid
|
| bearer_of | |
| alternative term |
anthropodesoxycholic acid
7alpha-hydroxylithocholic acid
3alpha,7alpha-Dihydroxy-5beta-cholanic acid
chenic acid
gallodesoxycholic acid
anthropodeoxycholic acid
CDCA
Chenix
Chenodiol
3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid
Chenodeoxycholic acid
See more
See less
|
| is conjugate acid of |
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