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CHEBI:89351 - PG(18:2(9Z,12Z)/16:0)

ChEBI IDCHEBI:89351
ChEBI NamePG(18:2(9Z,12Z)/16:0)
Stars
Last Modified11 April 2017
DownloadsMolfile
FormulaC40H75O10P
Net Charge0
Average Mass747.004
Monoisotopic Mass746.50979
SMILES[H][C@](O)(CO)COP(=O)(O)OC[C@@]([H])(COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C40H75O10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-39(43)47-35-38(36-49-51(45,46)48-34-37(42)33-41)50-40(44)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13,17-18,37-38,41-42H,3-10,12,14-16,19-36H2,1-2H3,(H,45,46)/b13-11-,18-17-/t37-,38+/m0/s1
InChIKeyIYKXCQWBMRYBPI-WLGRLVTESA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood (UBERON:0000178) PubMed (20671299)
Brassica napus (ncbitaxon:3708) - MetaboLights (MTBLS312) From MetaboLights
Roles Classification
Biological Roles:
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).
ChEBI Ontology
Outgoing Relation(s)
PG(18:2(9Z,12Z)/16:0) (CHEBI:89351) is a phosphatidylglycerol (18:2/16:0) (CHEBI:136800)
IUPAC Name 
[(2S)-2,3-dihydroxypropoxy][(2R)-2-(hexadecanoyloxy)-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy]phosphinic acid
Synonyms  Source
GPG(18:2n6/16:0)HMDB
1-(9Z,12Z-Octadecadienoyl)-2-hexadecanoyl-sn-glycero-3-phospho-(1'-glycerol)HMDB
Phosphatidylglycerol(18:2n6/16:0)HMDB
PG(18:2n6/16:0)HMDB
GPG(18:2w6/16:0)HMDB
GPG(18:2/16:0)HMDB
Manual XrefsDatabases
HMDB0010645HMDB
CPD-8086MetaCyc
Citations