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CHEBI:186478 - PI(10:0/16:1(9Z))

ChEBI IDCHEBI:186478
ChEBI NamePI(10:0/16:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H65O13P
Net Charge0
Average Mass724.866
Monoisotopic Mass724.41628
SMILESCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O
InChIInChI=1S/C35H65O13P/c1-3-5-7-9-11-12-13-14-15-16-18-20-22-24-29(37)47-27(25-45-28(36)23-21-19-17-10-8-6-4-2)26-46-49(43,44)48-35-33(41)31(39)30(38)32(40)34(35)42/h12-13,27,30-35,38-42H,3-11,14-26H2,1-2H3,(H,43,44)/b13-12-/t27-,30?,31-,32?,33?,34?,35?/m1/s1
InChIKeyYOFWHMBVUYEZQE-NFPZGIJYSA-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(10:0/16:1(9Z)) (CHEBI:186478) is a phosphatidylinositol (CHEBI:28874)
IUPAC Name 
[(2R)-1-decanoyloxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (Z)-hexadec-9-enoate
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