CHEBI:73868 - 1-(11Z-octadecenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine

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ChEBI Name 1-(11Z-octadecenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:73868
ChEBI ASCII Name 1-(11Z-octadecenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine
Definition A phosphatidylcholine 40:6 in which the acyl groups at C-1 and C-2 are (11Z)-octadecenoyl and (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C48H84NO8P
Net Charge 0
Average Mass 834.15620
Monoisotopic Mass 833.59346
InChI InChI=1S/C48H84NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-39-41-48(51)57-46(45-56-58(52,53)55-43-42-49(3,4)5)44-54-47(50)40-38-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h8,10,14,16-17,19-20,22,24-25,29,31,46H,6-7,9,11-13,15,18,21,23,26-28,30,32-45H2,1-5H3/b10-8-,16-14-,19-17-,22-20-,25-24-,31-29-/t46-/m1/s1
InChIKey FYVNIFOYDIIODX-KNKJIUSSSA-N
SMILES CCCCCC\C=C/CCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC
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 40:6 )
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ChEBI Ontology
Outgoing 1-(11Z-octadecenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine (CHEBI:73868) has functional parent (7Z,10Z,13Z,16Z,19Z)-docosapentaenoic acid (CHEBI:53488)
1-(11Z-octadecenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine (CHEBI:73868) has functional parent cis-vaccenic acid (CHEBI:50464)
1-(11Z-octadecenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine (CHEBI:73868) is a phosphatidylcholine 40:6 (CHEBI:64431)
IUPAC Name
(2R)-2-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]-3-[(11Z)-octadec-11-enoyloxy]propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-Vaccenoyl-2-docosapentaenoyl-sn-glycero-3-phosphocholine HMDB
GPCho 18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z) ChEBI
GPCho(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) ChEBI
PC 18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z) ChEBI
PC(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) ChEBI
phosphatidylcholine(18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z)) ChEBI
Manual Xrefs Databases
HMDB0008089 HMDB
LMGP01010846 LIPID MAPS
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Last Modified
26 September 2013