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CHEBI:72995 - 3-hydroxybutyrylcarnitine

ChEBI IDCHEBI:72995
ChEBI Name3-hydroxybutyrylcarnitine
Stars
DefinitionAn O-acylcarnitine having 3-hydroxybutyryl as the acyl substituent.
Last Modified13 May 2013
Submittermwilliams
DownloadsMolfile
FormulaC11H21NO5
Net Charge0
Average Mass247.291
Monoisotopic Mass247.14197
SMILESCC(O)CC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C11H21NO5/c1-8(13)5-11(16)17-9(6-10(14)15)7-12(2,3)4/h8-9,13H,5-7H2,1-4H3
InChIKeyUEFRDQSMQXDWTO-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
3-hydroxybutyrylcarnitine (CHEBI:72995) has functional parent carnitine (CHEBI:17126)
3-hydroxybutyrylcarnitine (CHEBI:72995) has role metabolite (CHEBI:25212)
3-hydroxybutyrylcarnitine (CHEBI:72995) is a O-acylcarnitine (CHEBI:17387)
3-hydroxybutyrylcarnitine (CHEBI:72995) is a ammonium betaine (CHEBI:35284)
3-hydroxybutyrylcarnitine (CHEBI:72995) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
3-[(3-hydroxybutanoyl)oxy]-4-(trimethylazaniumyl)butanoate
Synonyms  Source
β-hydroxybutyrylcarnitineChEBI
3-[(3-hydroxybutanoyl)oxy]-4-(trimethylammonio)butanoateIUPAC
Citations