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CHEBI:178112 - (4-Hydroxybenzoyl)choline

ChEBI IDCHEBI:178112
ChEBI Name(4-Hydroxybenzoyl)choline
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18NO3
Net Charge+1
Average Mass224.280
Monoisotopic Mass224.12812
SMILESC[N+](C)(C)CCOC(=O)c1ccc(O)cc1
InChIInChI=1S/C12H17NO3/c1-13(2,3)8-9-16-12(15)10-4-6-11(14)7-5-10/h4-7H,8-9H2,1-3H3/p+1
InChIKeyBAPAICNRGIBFJT-UHFFFAOYSA-O
Species of MetaboliteComponentSourceComments
Arisaema erubescens (ncbitaxon:228806) bulb (BTO:0000159) MetaboLights (MTBLS2858)
ChEBI Ontology
Outgoing Relation(s)
(4-Hydroxybenzoyl)choline (CHEBI:178112) is a 4-hydroxybenzoate ester (CHEBI:79323)
IUPAC Name 
2-(4-hydroxybenzoyl)oxyethyl-trimethylazanium
Manual XrefsDatabases
HMDB0029559HMDB
133307ChemSpider
Registry NumbersSources
CAS:5094-31-5ChemIDplus