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CHEBI:131660 - 1-heptadecanoyl-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:131660
ChEBI Name1-heptadecanoyl-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine
Stars
ASCII Name1-heptadecanoyl-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine
DefinitionA 1,2-diacyl-sn-glycero-3-phosphocholine in which the acyl groups at positions 1 and 2 are specified as heptadecanoyl and (9Z,12Z,15Z)-octadecatrienoyl respectively.
Last Modified15 November 2016
Submittermwilliams
DownloadsMolfile
FormulaC43H80NO8P
Net Charge0
Average Mass770.086
Monoisotopic Mass769.56216
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C43H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44(3,4)5)39-49-42(45)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,41H,6-7,9,11-13,15,17-19,21,23-40H2,1-5H3/b10-8-,16-14-,22-20-/t41-/m1/s1
InChIKeyJWRXJXZFMNQZBD-CAPSFDDTSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090)
- MetaboLights (MTBLS334)
- PubMed (27471436)
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
1-heptadecanoyl-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:131660) has functional parent heptadecanoic acid (CHEBI:32365)
1-heptadecanoyl-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:131660) has functional parent α-linolenic acid (CHEBI:27432)
1-heptadecanoyl-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:131660) has role mouse metabolite (CHEBI:75771)
1-heptadecanoyl-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:131660) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
(2R)-3-(heptadecanoyloxy)-2-{[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
PC(17:0/18:3(9Z,12Z,15Z))ChEBI
1-heptadecanoyl-2-(α-linolenoyl)-sn-glycero-3-phosphocholineChEBI
1-heptadecanoyl-2-linolenoyl-sn-glycero-3-phosphocholineChEBI
phosphatidylcholine (17:0/18:3(9Z,12Z,15Z))ChEBI
PC(17:0/18:3)ChEBI
1-heptadecanoyl-2-(9Z,12Z,15Z-octadecatrienoyl)-glycero-3-phosphocholineLIPID MAPS
Manual XrefsDatabases
LMGP01011507LIPID MAPS
Registry NumbersSources
Reaxys:30084828Reaxys
Citations