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CHEBI:187568 - PI(13:0/15:1(9Z))

Default Structure
ChEBI IDCHEBI:187568
ChEBI NamePI(13:0/15:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H69O13P
Net Charge0
Average Mass752.920
Monoisotopic Mass752.44758
SMILESCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O
InChIInChI=1S/C37H69O13P/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-31(39)49-29(27-47-30(38)25-23-21-19-17-14-12-10-8-6-4-2)28-48-51(45,46)50-37-35(43)33(41)32(40)34(42)36(37)44/h11,13,29,32-37,40-44H,3-10,12,14-28H2,1-2H3,(H,45,46)/b13-11-/t29-,32?,33-,34?,35?,36?,37?/m1/s1
InChIKeyFGZZWUUJPGPZFC-VTRKVFTOSA-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(13:0/15:1(9Z)) (CHEBI:187568) is a phosphatidylinositol (CHEBI:28874)
IUPAC Name 
[(2R)-1-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-3-tridecanoyloxypropan-2-yl] (Z)-pentadec-9-enoate
Manual XrefsDatabases
LMGP06010039LIPID MAPS