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Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-18 01:59:20 UTC
Update Date2022-08-31 18:27:35 UTC
Metabolite IDMMDBc0032030
Metabolite Identification
Common NameLPA(18:1(9Z)/0:0)
DescriptionNULL
Structure
Synonyms
Molecular FormulaC21H41O7P
Average Mass436.5198
Monoisotopic Mass436.258990178
IUPAC Name[(2R)-2-hydroxy-3-[(9Z)-octadec-9-enoyloxy]propoxy]phosphonic acid
Traditional Name1-oleoyl lysophosphatidic acid
CAS Registry NumberNot Available
SMILES
CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@](O)([H])COP(O)(=O)O
InChI Identifier
InChI=1S/C21H41O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)27-18-20(22)19-28-29(24,25)26/h9-10,20,22H,2-8,11-19H2,1H3,(H2,24,25,26)/b10-9-/t20-/m1/s1
InChI KeyWRGQSWVCFNIUNZ-GDCKJWNLSA-N