O-(13-carboxytridecanoyl)carnitine (CHEBI:73071)

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ChEBI Name	O-(13-carboxytridecanoyl)carnitine

ChEBI ID	CHEBI:73071

ChEBI ASCII Name	O-(13-carboxytridecanoyl)carnitine

Definition	An O-acylcarnitine having 13-carboxytridecanoyl as the acyl substituent.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C21H39NO6

Net Charge

Average Mass

401.53750

Monoisotopic Mass

401.27774

InChI

InChI=1S/C21H39NO6/c1-22(2,3)17-18(16-20(25)26)28-21(27)15-13-11-9-7-5-4-6-8-10-12-14-19(23)24/h18H,4-17H2,1-3H3,(H-,23,24,25,26)

InChIKey

AHBCTRVDGQMKHC-UHFFFAOYSA-N

SMILES

C[N+](C)(C)CC(CC([O-])=O)OC(=O)CCCCCCCCCCCCC(O)=O

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	O-(13-carboxytridecanoyl)carnitine (CHEBI:73071) has functional parent carnitine (CHEBI:17126) O-(13-carboxytridecanoyl)carnitine (CHEBI:73071) has role metabolite (CHEBI:25212) O-(13-carboxytridecanoyl)carnitine (CHEBI:73071) is a O-acylcarnitine (CHEBI:17387) O-(13-carboxytridecanoyl)carnitine (CHEBI:73071) is a ammonium betaine (CHEBI:35284) O-(13-carboxytridecanoyl)carnitine (CHEBI:73071) is a carboxylic ester (CHEBI:33308)

IUPAC Name

3-[(13-carboxytridecanoyl)oxy]-4-(trimethylazaniumyl)butanoate

Synonyms	Sources
13-carboxytridecanoylcarnitine	ChEBI
3-[(13-carboxytridecanoyl)oxy]-4-(trimethylammonio)butanoate	IUPAC

Citation	Type	Source
23315938	PubMed citation	Europe PMC

Last Modified

14 May 2013