CHEBI:86099 - 1-[(9Z,12Z)-octadecadienoyl]-2-hexadecanoyl-sn-glycero-3-phosphocholine

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ChEBI Name 1-[(9Z,12Z)-octadecadienoyl]-2-hexadecanoyl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:86099
ChEBI ASCII Name 1-[(9Z,12Z)-octadecadienoyl]-2-hexadecanoyl-sn-glycero-3-phosphocholine
Definition A phosphatidylcholine 34:2 in which the acyl groups specified at positions 1 and 2 are (9Z,12Z)-octadecadienoyl and linoleoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C42H80NO8P
Net Charge 0
Average Mass 758.06030
Monoisotopic Mass 757.56216
InChI InChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h14,16,20-21,40H,6-13,15,17-19,22-39H2,1-5H3/b16-14-,21-20-/t40-/m1/s1
InChIKey FWMYJLDHIVCJCT-ZTIMHPMXSA-N
SMILES CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)COP([O-])(=O)OCC[N+](C)(C)C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via phosphatidylcholine 34:2 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-[(9Z,12Z)-octadecadienoyl]-2-hexadecanoyl-sn-glycero-3-phosphocholine (CHEBI:86099) has functional parent hexadecanoic acid (CHEBI:15756)
1-[(9Z,12Z)-octadecadienoyl]-2-hexadecanoyl-sn-glycero-3-phosphocholine (CHEBI:86099) has functional parent linoleic acid (CHEBI:17351)
1-[(9Z,12Z)-octadecadienoyl]-2-hexadecanoyl-sn-glycero-3-phosphocholine (CHEBI:86099) is a phosphatidylcholine 34:2 (CHEBI:64516)
IUPAC Name
(2R)-2-(hexadecanoyloxy)-3-{[(9Z,12Z)-octadeca-9,12-dienoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-Linoleoyl-2-palmitoyl-sn-glycero-3-phosphocholine HMDB
GPCho(18:2/16:0) HMDB
GPCho(18:2n6/16:0) HMDB
GPCho(18:2w6/16:0) HMDB
PC(18:2(9Z,12Z)/16:0) LIPID MAPS
PC(18:2/16:0) HMDB
PC(18:2n6/16:0) HMDB
PC(18:2w6/16:0) HMDB
Phosphatidylcholine(18:2/16:0) HMDB
Phosphatidylcholine(18:2n6/16:0) HMDB
Phosphatidylcholine(18:2w6/16:0) HMDB
Manual Xrefs Databases
HMDB0008133 HMDB
LMGP01010932 LIPID MAPS
View more database links
Last Modified
23 October 2015