CHEBI:185041 - Alpha-Linolenyl carnitine

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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 Alpha-Linolenyl carnitine
ChEBI ID CHEBI:185041
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H43NO4
Net Charge 0
Average Mass 421.622
Monoisotopic Mass 421.31921
InChI InChI=1S/C25H43NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(26(2,3)4)21-22-24(27)28/h6-7,9-10,12-13,23H,5,8,11,14-22H2,1-4H3/b7-6-,10-9-,13-12-/t23-/m0/s1
InChIKey DFVGGGHKDAHYIU-UHMZJXMFSA-N
SMILES O([C@H]([N+](C)(C)C)CCC([O-])=O)C(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
Metabolite of Species Details
Bos taurus (NCBI:txid9913) Found in spermatozoon (BTO:0001277). of strain Holstein [LBO:0000132] See: MetaboLights Study
ChEBI Ontology
Outgoing Alpha-Linolenyl carnitine (CHEBI:185041) is a fatty acid ester (CHEBI:35748)
IUPAC Name
(4S)-4-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-4-(trimethylazaniumyl)butanoate
Manual Xrefs Databases
30776571 ChemSpider
HMDB0006319 HMDB
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