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CHEBI:230088 - (5Z,7Z,10Z,13Z,16Z,19Z)-4-Hydroxydocosa-5,7,10,13,16,19-hexaenoylcarnitine

ChEBI IDCHEBI:230088
ChEBI Name(5Z,7Z,10Z,13Z,16Z,19Z)-4-Hydroxydocosa-5,7,10,13,16,19-hexaenoylcarnitine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H45NO5
Net Charge0
Average Mass487.681
Monoisotopic Mass487.32977
SMILESCC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/C=C/C(O)CCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C29H45NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26(31)22-23-29(34)35-27(24-28(32)33)25-30(2,3)4/h6-7,9-10,12-13,15-16,18-21,26-27,31H,5,8,11,14,17,22-25H2,1-4H3/b7-6+,10-9+,13-12+,16-15+,19-18+,21-20+
InChIKeyMCGMMQKEFPHKPN-ZAQYYTCTSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
(5Z,7Z,10Z,13Z,16Z,19Z)-4-Hydroxydocosa-5,7,10,13,16,19-hexaenoylcarnitine (CHEBI:230088) is a O-acylcarnitine (CHEBI:17387)
IUPAC Name 
3-[(5E,7E,10E,13E,16E,19E)-4-hydroxydocosa-5,7,10,13,16,19-hexaenoyl]oxy-4-(trimethylazaniumyl)butanoate