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CHEBI:191649 - PIP(16:1(9Z)/16:1(9Z))

ChEBI IDCHEBI:191649
ChEBI NamePIP(16:1(9Z)/16:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H76O16P2
Net Charge0
Average Mass886.991
Monoisotopic Mass886.46086
SMILESCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)O[C@H]1C(O)C(O)C(O)[C@@H](OP(=O)(O)O)C1O)OC(=O)CCCCCCC/C=C\CCCCCC
InChIInChI=1S/C41H76O16P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)53-31-33(55-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-54-59(51,52)57-41-38(46)36(44)37(45)40(39(41)47)56-58(48,49)50/h13-16,33,36-41,44-47H,3-12,17-32H2,1-2H3,(H,51,52)(H2,48,49,50)/b15-13-,16-14-/t33-,36?,37?,38?,39?,40-,41+/m1/s1
InChIKeyDEQQATKVNVJGLU-GDQVUODMSA-N
Species of MetaboliteComponentSourceComments
Solanum tuberosum (ncbitaxon:4113) leaf (BTO:0000713) MetaboLights (MTBLS4365)
ChEBI Ontology
Outgoing Relation(s)
PIP(16:1(9Z)/16:1(9Z)) (CHEBI:191649) is a glycerophosphoinositol phosphate (CHEBI:35771)
IUPAC Name 
[(2R)-2-[(Z)-hexadec-9-enoyl]oxy-3-[hydroxy-[(1S,5R)-2,3,4,6-tetrahydroxy-5-phosphonooxycyclohexyl]oxyphosphoryl]oxypropyl] (Z)-hexadec-9-enoate
Manual XrefsDatabases
HMDB0009939HMDB
24767820ChemSpider