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CHEBI:74330 - lysophosphatidic acid 0:0/18:2(9Z,12Z)

ChEBI IDCHEBI:74330
ChEBI Namelysophosphatidic acid 0:0/18:2(9Z,12Z)
Stars
ASCII Namelysophosphatidic acid 0:0/18:2(9Z,12Z)
DefinitionA 2-acyl-sn-glycerol 3-phosphate having (9Z,12Z)-octadeca-9,12-dienoyl as the 2-O-acyl group.
Last Modified5 September 2013
Submittermwilliams
DownloadsMolfile
FormulaC21H39O7P
Net Charge0
Average Mass434.510
Monoisotopic Mass434.24334
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](CO)COP(=O)(O)O
InChIInChI=1S/C21H39O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)28-20(18-22)19-27-29(24,25)26/h6-7,9-10,20,22H,2-5,8,11-19H2,1H3,(H2,24,25,26)/b7-6-,10-9-/t20-/m1/s1
InChIKeyPALVOIADDFXQGT-KKFOGOCZSA-N
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
lysophosphatidic acid 0:0/18:2(9Z,12Z) (CHEBI:74330) has role metabolite (CHEBI:25212)
lysophosphatidic acid 0:0/18:2(9Z,12Z) (CHEBI:74330) is a 2-acyl-sn-glycero-3-phosphate (CHEBI:17936)
IUPAC Name 
(2R)-1-hydroxy-3-(phosphonooxy)propan-2-yl (9Z,12Z)-octadeca-9,12-dienoate
Synonyms  Source
LPA(0:0/18:2(9Z,12Z))ChEBI
LPA 0:0/18:2(9Z,12Z)ChEBI
lysophosphatidic acid(0:0/18:2(9Z,12Z))ChEBI
2-(9Z,12Z-Octadecadienoyl)-phosphatidic acidHMDB
2-Linoleoyl-glycero-3-phosphateHMDB
Manual XrefsDatabases
HMDB0007852HMDB
Registry NumbersSources
Reaxys:21630698Reaxys