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Biological and Environmental Research Ontology
Last uploaded:
December 23, 2022
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| Id | http://purl.obolibrary.org/obo/CHEBI_28865
http://purl.obolibrary.org/obo/CHEBI_28865
|
|---|---|
| Preferred Name | taurocholic acid |
| Definitions |
A bile acid taurine conjugate of cholic acid that usually occurs as the sodium salt of bile in mammals.
|
| Synonyms |
Choloyl-taurine
Cholyltaurine
3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid 24-taurine
Taurocholate
cholic acid taurine conjugate
N-choloyltaurine
Taurocholic acid
2-[(3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonic acid
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| definition | A bile acid taurine conjugate of cholic acid that usually occurs as the sodium salt of bile in mammals. |
|---|---|
| label |
taurocholic acid
|
| prefLabel |
taurocholic acid
|
| database_cross_reference |
PMID:24412572
Wikipedia:Taurocholic_acid
KEGG:C05122
PMID:11160372
PMID:24551170
HMDB:HMDB0000036
DrugBank:DB04348
LINCS:LSM-5866
LIPID_MAPS_instance:LMST05040001
Reaxys:2956951
KEGG:C02258
CAS:81-24-3
Beilstein:2956951
PDBeChem:TCH
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|
| notation |
CHEBI:28865
|
| in_subset | |
| inchi |
InChI=1S/C26H45NO7S/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34)/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1
|
| has_related_synonym |
Choloyl-taurine
Cholyltaurine
3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid 24-taurine
Taurocholate
cholic acid taurine conjugate
N-choloyltaurine
See more
See less
|
| id |
CHEBI:28865
|
| charge |
0
|
| has_obo_namespace |
chebi_ontology
|
| formula |
C26H45NO7S
|
| subClassOf | |
| inchikey |
WBWWGRHZICKQGZ-HZAMXZRMSA-N
|
| mass |
515.70300
|
| monoisotopicmass |
515.29167
|
| has_functional_parent | |
| has_alternative_id |
CHEBI:26854
CHEBI:45901
CHEBI:3672
CHEBI:9408
|
| type | |
| smiles |
[H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])C[C@H](O)[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@H](O)C2)[C@H](C)CCC(=O)NCCS(O)(=O)=O
|
| RO_0000087 | |
| has_exact_synonym |
Taurocholic acid
2-[(3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonic acid
|
| bearer of | |
| alternative term |
Choloyl-taurine
Cholyltaurine
3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid 24-taurine
Taurocholate
cholic acid taurine conjugate
N-choloyltaurine
Taurocholic acid
2-[(3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonic acid
See more
See less
|
| is_conjugate_acid_of |
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