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CHEBI:178067 - Eicoseneoyl-carnitine

ChEBI IDCHEBI:178067
ChEBI NameEicoseneoyl-carnitine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H51NO4
Net Charge0
Average Mass453.708
Monoisotopic Mass453.38181
SMILESCCCCCCCCCCCCCCCCCC=CC(=O)C(O)(CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C27H51NO4/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/h21-22,32H,5-20,23-24H2,1-4H3
InChIKeyKFMWEXOSEGPNKJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2187)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Eicoseneoyl-carnitine (CHEBI:178067) is a very long-chain fatty acid (CHEBI:27283)
IUPAC Name 
3-hydroxy-4-oxo-3-[(trimethylazaniumyl)methyl]tricos-5-enoate