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CHEBI:191289 - 18:3-16:3-PA

ChEBI IDCHEBI:191289
ChEBI Name18:3-16:3-PA
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H59O8P
Net Charge-2
Average Mass662.845
Monoisotopic Mass662.39585
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCC/C=C\C/C=C\C/C=C\CC
InChIInChI=1S/C37H61O8P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-36(38)43-33-35(34-44-46(40,41)42)45-37(39)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h5-8,11-14,17-19,22,35H,3-4,9-10,15-16,20-21,23-34H2,1-2H3,(H2,40,41,42)/p-2/b7-5-,8-6-,13-11-,14-12-,18-17-,22-19-/t35-/m1/s1
InChIKeyINZFHWSISOLQEQ-CXGDOZRDSA-L
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
18:3-16:3-PA (CHEBI:191289) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-2-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropyl] phosphate