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CHEBI:186750 - PI(14:0/14:1(9Z))

ChEBI IDCHEBI:186750
ChEBI NamePI(14:0/14:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H69O13P
Net Charge0
Average Mass752.920
Monoisotopic Mass752.44758
SMILESCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O
InChIInChI=1S/C37H69O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-30(38)47-27-29(49-31(39)26-24-22-20-18-16-14-12-10-8-6-4-2)28-48-51(45,46)50-37-35(43)33(41)32(40)34(42)36(37)44/h10,12,29,32-37,40-44H,3-9,11,13-28H2,1-2H3,(H,45,46)/b12-10-/t29-,32?,33-,34?,35?,36?,37?/m1/s1
InChIKeyHYAQQBFACIUEMU-HESRPIQDSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
PI(14:0/14:1(9Z)) (CHEBI:186750) is a phosphatidylinositol (CHEBI:28874)
IUPAC Name 
[(2R)-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-2-[(Z)-tetradec-9-enoyl]oxypropyl] tetradecanoate
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