CHEBI:228644 - CAR 16:2

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name CAR 16:2
ChEBI ID CHEBI:228644
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H42NO4
Net Charge +1
Average Mass 396.591
Monoisotopic Mass 396.31084
InChI InChI=1S/C23H41NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(19-22(25)26)20-24(2,3)4/h12-13,15-16,21H,5-11,14,17-20H2,1-4H3/p+1/b13-12-,16-15+
InChIKey DPIJSJWXUXNTJD-OFXORYEXSA-O
SMILES O(C(C[N+](C)(C)C)CC(O)=O)C(=O)CC/C=C/C/C=C\CCCCCCCC
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: MetaboLights Study
ChEBI Ontology
Outgoing CAR 16:2 (CHEBI:228644) is a O-acylcarnitine (CHEBI:17387)
IUPAC Name
[3-carboxy-2-[(4E,7Z)-hexadeca-4,7-dienoyl]oxypropyl]-trimethylazanium