CHEBI:68830 - O-decanoylcarnitine

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ChEBI Name O-decanoylcarnitine
ChEBI ID CHEBI:68830
ChEBI ASCII Name O-decanoylcarnitine
Definition An O-acylcarnitine compound having decanoyl as the acyl substituent.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C17H33NO4
Net Charge 0
Average Mass 315.449
Monoisotopic Mass 315.24096
InChI InChI=1S/C17H33NO4/c1-5-6-7-8-9-10-11-12-17(21)22-15(13-16(19)20)14-18(2,3)4/h15H,5-14H2,1-4H3
InChIKey LZOSYCMHQXPBFU-UHFFFAOYSA-N
SMILES O(C(C[N+](C)(C)C)CC([O-])=O)C(CCCCCCCCC)=O
Roles Classification
Biological Role(s): human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
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ChEBI Ontology
Outgoing O-decanoylcarnitine (CHEBI:68830) has role human urinary metabolite (CHEBI:84087)
O-decanoylcarnitine (CHEBI:68830) is a O-acylcarnitine (CHEBI:17387)
O-decanoylcarnitine (CHEBI:68830) is a decanoate ester (CHEBI:87658)
Incoming O-decanoyl-L-carnitine (CHEBI:28717) is a O-decanoylcarnitine (CHEBI:68830)
IUPAC Name
3-(decanoyloxy)-4-(trimethylammonio)butanoate
Synonym Source
decanoylcarnitine ChEBI
Manual Xref Database
HMDB0000651 HMDB
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Registry Numbers Types Sources
1492-27-9 CAS Registry Number ChemIDplus
4145303 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
22770225 PubMed citation Europe PMC
23315938 PubMed citation Europe PMC
Last Modified
23 October 2015