CHEBI:36257 - taurocholate

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ChEBI Name taurocholate
Definition An organosulfonate oxoanion that is the conjugate base of taurocholic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H44NO7S
Net Charge -1
Average Mass 514.69610
Monoisotopic Mass 514.28440
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)/p-1/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1
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
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing taurocholate (CHEBI:36257) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
taurocholate (CHEBI:36257) has role human metabolite (CHEBI:77746)
taurocholate (CHEBI:36257) is a cholanic acid conjugate anion (CHEBI:131879)
taurocholate (CHEBI:36257) is a organosulfonate oxoanion (CHEBI:33554)
taurocholate (CHEBI:36257) is conjugate base of taurocholic acid (CHEBI:28865)
Incoming taurocholate 7-sulfate(2−) (CHEBI:172394) has functional parent taurocholate (CHEBI:36257)
sodium taurocholate (CHEBI:36276) has part taurocholate (CHEBI:36257)
taurocholic acid (CHEBI:28865) is conjugate acid of taurocholate (CHEBI:36257)
Synonym Source
taurocholate UniProt
Registry Numbers Types Sources
3919947 Beilstein Registry Number Beilstein
3919947 Reaxys Registry Number Reaxys
Last Modified
21 January 2016