CHEBI:88851 - PC(22:4(7Z,10Z,13Z,16Z)/16:1(9Z))

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ChEBI Name PC(22:4(7Z,10Z,13Z,16Z)/16:1(9Z))
ChEBI ID CHEBI:88851
Stars This entity has been manually annotated by a third party.
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Formula C46H82NO8P
Net Charge 0
Average Mass 808.121
Monoisotopic Mass 807.57781
InChI InChI=1S/C46H82NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-28-30-32-34-36-38-45(48)52-42-44(43-54-56(50,51)53-41-40-47(3,4)5)55-46(49)39-37-35-33-31-29-26-19-17-15-13-11-9-7-2/h14,16-17,19-21,23-24,27-28,44H,6-13,15,18,22,25-26,29-43H2,1-5H3/b16-14-,19-17-,21-20-,24-23-,28-27-/t44-/m1/s1
InChIKey STHWQCYHQJBDDB-SYONOARRSA-N
SMILES C([C@@](COC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)(OC(CCCCCCC/C=C\CCCCCC)=O)[H])OP([O-])(=O)OCC[N+](C)(C)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed
Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation)
ChEBI Ontology
Outgoing PC(22:4(7Z,10Z,13Z,16Z)/16:1(9Z)) (CHEBI:88851) 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-[(9Z)-hexadec-9-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium HMDB
1-Adrenoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine HMDB
GPCho(22:4/16:1) HMDB
GPCho(22:4n6/16:1n7) HMDB
GPCho(22:4w6/16:1w7) HMDB
GPCho(38:5) HMDB
Lecithin HMDB
PC aa C38:5 HMDB
PC(22:4/16:1) HMDB
PC(22:4n6/16:1n7) HMDB
PC(22:4w6/16:1w7) HMDB
PC(38:5) HMDB
Phosphatidylcholine(22:4/16:1) HMDB
Phosphatidylcholine(22:4n6/16:1n7) HMDB
Phosphatidylcholine(22:4w6/16:1w7) HMDB
Phosphatidylcholine(38:5) HMDB
Manual Xrefs Databases
HMDB0008627 HMDB
Lecithin Wikipedia
PHOSPHATIDYLCHOLINE MetaCyc
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Citation Waiting for Citations Type Source
24023812 PubMed citation Europe PMC