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CHEBI:133177 - glycohyocholate

ChEBI IDCHEBI:133177
ChEBI Nameglycohyocholate
Stars
DefinitionA cholanic acid conjugate anion that is the conjugate base of glycohyocholic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified26 August 2016
SubmitterSteve
DownloadsMolfile
FormulaC26H42NO6
Net Charge-1
Average Mass464.623
Monoisotopic Mass464.30176
SMILES[H][C@@]12CC[C@]([H])([C@H](C)CCC(=O)NCC(=O)[O-])[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@@H](O)C[C@@]3([H])[C@@H](O)[C@@H](O)[C@@]21[H]
InChIInChI=1S/C26H43NO6/c1-14(4-7-20(29)27-13-21(30)31)16-5-6-17-22-18(9-11-25(16,17)2)26(3)10-8-15(28)12-19(26)23(32)24(22)33/h14-19,22-24,28,32-33H,4-13H2,1-3H3,(H,27,29)(H,30,31)/p-1/t14-,15-,16-,17+,18+,19+,22+,23-,24+,25-,26-/m1/s1
InChIKeyZQYUKJFJPJDMMR-ZDWCHQGWSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (27458508)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
glycohyocholate (CHEBI:133177) has role human metabolite (CHEBI:77746)
glycohyocholate (CHEBI:133177) is a N-acylglycinate (CHEBI:57670)
glycohyocholate (CHEBI:133177) is a cholanic acid conjugate anion (CHEBI:131879)
glycohyocholate (CHEBI:133177) is conjugate base of glycohyocholic acid (CHEBI:133176)
Incoming Relation(s)
glycohyocholic acid (CHEBI:133176) is conjugate acid of glycohyocholate (CHEBI:133177)
Synonyms  Source
hyocholic acid-glycine conjugate anionChEBI
N-hyocholoylglycinateChEBI
Citations