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CHEBI:183977 - 1-hexadecanoyl-2-octadecadienoyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:183977
ChEBI Name1-hexadecanoyl-2-octadecadienoyl-sn-glycero-3-phosphocholine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H81NO8P
Net Charge+1
Average Mass759.083
Monoisotopic Mass758.56943
SMILESCCCCCCCCCCCCCC=CC=CC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C
InChIInChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h29,31,33,35,40H,6-28,30,32,34,36-39H2,1-5H3/p+1/t40-/m1/s1
InChIKeyCFORBWCMGILWNN-RRHRGVEJSA-O
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) small intestine (BTO:0000651) MetaboLights (MTBLS3486) Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424]
Nippostrongylus brasiliensis (ncbitaxon:27835) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3486)
ChEBI Ontology
Outgoing Relation(s)
1-hexadecanoyl-2-octadecadienoyl-sn-glycero-3-phosphocholine (CHEBI:183977) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
2-[[(2R)-3-hexadecanoyloxy-2-octadeca-2,4-dienoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium