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CHEBI:183947 - Pi(16:0/9-hode)

ChEBI IDCHEBI:183947
ChEBI NamePi(16:0/9-hode)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H79O14P
Net Charge0
Average Mass851.065
Monoisotopic Mass850.52074
SMILESCCCCC/C=C\C=C\C(O)CCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O
InChIInChI=1S/C43H79O14P/c1-3-5-7-9-11-12-13-14-15-16-18-22-26-30-36(45)54-32-35(33-55-58(52,53)57-43-41(50)39(48)38(47)40(49)42(43)51)56-37(46)31-27-23-19-21-25-29-34(44)28-24-20-17-10-8-6-4-2/h17,20,24,28,34-35,38-44,47-51H,3-16,18-19,21-23,25-27,29-33H2,1-2H3,(H,52,53)/b20-17-,28-24+
InChIKeyURFSWIVVYAHACE-PCHRQBGLSA-N
Species of MetaboliteComponentSourceComments
Nippostrongylus brasiliensis (ncbitaxon:27835) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3486)
Mus musculus (ncbitaxon:10090) small intestine (BTO:0000651) MetaboLights (MTBLS3486) Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424]
ChEBI Ontology
Outgoing Relation(s)
Pi(16:0/9-hode) (CHEBI:183947) is a phosphatidylinositol (CHEBI:28874)
IUPAC Name 
[1-hexadecanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] (10E,12Z)-9-hydroxyoctadeca-10,12-dienoate