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CHEBI:34079 - {1-hexadecanoyl-2-[(Z)-octadec-9-enoyl]-sn-glycero-3-phospho}-1D-myo-inositol

ChEBI IDCHEBI:34079
ChEBI Name{1-hexadecanoyl-2-[(Z)-octadec-9-enoyl]-sn-glycero-3-phospho}-1D-myo-inositol
Stars
ASCII Name{1-hexadecanoyl-2-[(Z)-octadec-9-enoyl]-sn-glycero-3-phospho}-1D-myo-inositol
Last Modified16 August 2018
DownloadsMolfile
FormulaC43H81O13P
Net Charge0
Average Mass837.082
Monoisotopic Mass836.54148
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C43H81O13P/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/h17-18,35,38-43,46-50H,3-16,19-34H2,1-2H3,(H,51,52)/b18-17-/t35?,38-,39-,40+,41-,42-,43-/m1/s1
InChIKeyPDLAMJKMOKWLAJ-NSQTWWIKSA-N
ChEBI Ontology
Outgoing Relation(s)
{1-hexadecanoyl-2-[(Z)-octadec-9-enoyl]-sn-glycero-3-phospho}-1D-myo-inositol (CHEBI:34079) is a 1-phosphatidyl-1D-myo-inositol (CHEBI:16749)
Synonym  Source
1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-1'-myo-inositolKEGG COMPOUND
Manual XrefsDatabases
C13888KEGG COMPOUND