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CHEBI:192225 - PA(15:0/20:3(5Z,8Z,11Z))

ChEBI IDCHEBI:192225
ChEBI NamePA(15:0/20:3(5Z,8Z,11Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H69O8P
Net Charge0
Average Mass684.936
Monoisotopic Mass684.47301
SMILESCCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C38H69O8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-38(40)46-36(35-45-47(41,42)43)34-44-37(39)32-30-28-26-24-22-16-14-12-10-8-6-4-2/h17-18,20-21,25,27,36H,3-16,19,22-24,26,28-35H2,1-2H3,(H2,41,42,43)/b18-17-,21-20-,27-25-/t36-/m1/s1
InChIKeyQAILTPMANOZZIV-NLMUWFDISA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
PA(15:0/20:3(5Z,8Z,11Z)) (CHEBI:192225) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-1-pentadecanoyloxy-3-phosphonooxypropan-2-yl] (5Z,8Z,11Z)-icosa-5,8,11-trienoate
Manual XrefsDatabases
HMDB0114820HMDB
74876587ChemSpider