CHEBI:88869 - PC(22:4(7Z,10Z,13Z,16Z)/20:0)

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ChEBI Name PC(22:4(7Z,10Z,13Z,16Z)/20:0)
ChEBI ID CHEBI:88869
Stars This entity has been manually annotated by a third party.
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Formula C50H92NO8P
Net Charge 0
Average Mass 866.243
Monoisotopic Mass 865.65606
InChI InChI=1S/C50H92NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-29-26-23-21-19-17-15-13-11-9-7-2/h14,16,20,22,25,27,30,32,48H,6-13,15,17-19,21,23-24,26,28-29,31,33-47H2,1-5H3/b16-14-,22-20-,27-25-,32-30-/t48-/m1/s1
InChIKey MFAKYYBEUHGJJL-LFRGNPRBSA-N
SMILES C([C@@](COC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)(OC(CCCCCCCCCCCCCCCCCCC)=O)[H])OP([O-])(=O)OCC[N+](C)(C)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation)
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed
ChEBI Ontology
Outgoing PC(22:4(7Z,10Z,13Z,16Z)/20:0) (CHEBI:88869) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms Sources
(2-{[(2R)-3-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyloxy]-2-(icosanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium HMDB
1-Adrenoyl-2-arachidonyl-sn-glycero-3-phosphocholine HMDB
GPCho(22:4/20:0) HMDB
GPCho(22:4n6/20:0) HMDB
GPCho(22:4w6/20:0) HMDB
GPCho(42:4) HMDB
Lecithin HMDB
PC aa C42:4 HMDB
PC(22:4/20:0) HMDB
PC(22:4n6/20:0) HMDB
PC(22:4w6/20:0) HMDB
PC(42:4) HMDB
Phosphatidylcholine(22:4/20:0) HMDB
Phosphatidylcholine(22:4n6/20:0) HMDB
Phosphatidylcholine(22:4w6/20:0) HMDB
Phosphatidylcholine(42:4) HMDB
Manual Xrefs Databases
HMDB0008635 HMDB
Lecithin Wikipedia
PHOSPHATIDYLCHOLINE MetaCyc
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Citation Waiting for Citations Type Source
24023812 PubMed citation Europe PMC