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CHEBI:191354 - 16:1-18:3-PI

ChEBI IDCHEBI:191354
ChEBI Name16:1-18:3-PI
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H74O13P
Net Charge-1
Average Mass830.026
Monoisotopic Mass829.48725
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCC)COP(=O)([O-])OC1[C@H](O)[C@H](O)C(O)[C@H](O)[C@H]1O
InChIInChI=1S/C43H75O13P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(45)55-35(34-54-57(51,52)56-43-41(49)39(47)38(46)40(48)42(43)50)33-53-36(44)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-18,35,38-43,46-50H,3-4,6,8-10,12,15,19-34H2,1-2H3,(H,51,52)/p-1/b7-5-,13-11-,16-14-,18-17-/t35-,38?,39-,40+,41-,42-,43?/m1/s1
InChIKeyUCRVYUGOFYNFFW-XRDYPCPSSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) hTERT-RPE1 cell (BTO:0004790) MetaboLights (MTBLS682)
ChEBI Ontology
Outgoing Relation(s)
16:1-18:3-PI (CHEBI:191354) is a phosphatidylinositol (CHEBI:28874)
IUPAC Name 
[(2R)-3-[(Z)-hexadec-9-enoyl]oxy-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropyl] [(2R,3S,5R,6R)-2,3,4,5,6-pentahydroxycyclohexyl] phosphate