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CHEBI:188320 - PE(12:0/18:3(6Z,9Z,12Z))

ChEBI IDCHEBI:188320
ChEBI NamePE(12:0/18:3(6Z,9Z,12Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H64NO8P
Net Charge0
Average Mass657.870
Monoisotopic Mass657.43695
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C35H64NO8P/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-28-35(38)44-33(32-43-45(39,40)42-30-29-36)31-41-34(37)27-25-23-21-19-12-10-8-6-4-2/h11,13,15-16,18,20,33H,3-10,12,14,17,19,21-32,36H2,1-2H3,(H,39,40)/b13-11-,16-15-,20-18-/t33-/m1/s1
InChIKeyQHMYCULCBPDQHX-RUOLEGLLSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
PE(12:0/18:3(6Z,9Z,12Z)) (CHEBI:188320) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-dodecanoyloxypropan-2-yl] (6Z,9Z,12Z)-octadeca-6,9,12-trienoate
Manual XrefsDatabases
LMGP02010367LIPID MAPS
113375421ChemSpider