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CHEBI:176733 - eicosadienoylcarnitine

ChEBI IDCHEBI:176733
ChEBI Nameeicosadienoylcarnitine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H49NO4
Net Charge0
Average Mass451.692
Monoisotopic Mass451.36616
SMILESCCCCCCCCCCCCCCCC=CC=CC(=O)C(O)(CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C27H49NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25(29)27(32,23-26(30)31)24-28(2,3)4/h19-22,32H,5-18,23-24H2,1-4H3
InChIKeyNCGAULPMLCATTD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
eicosadienoylcarnitine (CHEBI:176733) is a very long-chain fatty acid (CHEBI:27283)
IUPAC Name 
3-hydroxy-4-oxo-3-[(trimethylazaniumyl)methyl]tricosa-5,7-dienoate