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CHEBI:190648 - ACar 22:6

Default Structure
ChEBI IDCHEBI:190648
ChEBI NameACar 22:6
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H46NO4
Net Charge+1
Average Mass472.690
Monoisotopic Mass472.34214
SMILESCC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CCC(=O)OC(CC(=O)O)C[N+](C)(C)C
InChIInChI=1S/C29H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-29(33)34-27(25-28(31)32)26-30(2,3)4/h6-7,9-10,12-13,15-16,18-19,21-22,27H,5,8,11,14,17,20,23-26H2,1-4H3/p+1/b7-6+,10-9+,13-12+,16-15+,19-18+,22-21+
InChIKeyWLLMYDQRCSWAST-BUHCESQUSA-O
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) liver (BTO:0000759) MetaboLights (MTBLS4163)
ChEBI Ontology
Outgoing Relation(s)
ACar 22:6 (CHEBI:190648) is a O-acylcarnitine (CHEBI:17387)
IUPAC Name 
[3-carboxy-2-[(4E,7E,10E,13E,16E,19E)-docosa-4,7,10,13,16,19-hexaenoyl]oxypropyl]-trimethylazanium