CHEBI:89424 - PC(18:4(6Z,9Z,12Z,15Z)/20:1(11Z))

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ChEBI Name PC(18:4(6Z,9Z,12Z,15Z)/20:1(11Z))
ChEBI ID CHEBI:89424
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/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h9,11,15,17,20-22,24,28,30,44H,6-8,10,12-14,16,18-19,23,25-27,29,31-43H2,1-5H3/b11-9-,17-15-,22-20-,24-21-,30-28-/t44-/m1/s1
InChIKey WJGXHQGSFRJRJR-JQMRBUEGSA-N
SMILES C([C@@](COC(CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)=O)(OC(CCCCCCCCC/C=C\CCCCCCCC)=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(18:4(6Z,9Z,12Z,15Z)/20:1(11Z)) (CHEBI:89424) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms Sources
(2-{[(2R)-2-[(11Z)-icos-11-enoyloxy]-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium HMDB
1-Stearidonoyl-2-eicosenoyl-sn-glycero-3-phosphocholine HMDB
GPCho(18:4/20:1) HMDB
GPCho(18:4n3/20:1n9) HMDB
GPCho(18:4w3/20:1w9) HMDB
GPCho(38:5) HMDB
Lecithin HMDB
PC aa C38:5 HMDB
PC(18:4/20:1) HMDB
PC(18:4n3/20:1n9) HMDB
PC(18:4w3/20:1w9) HMDB
PC(38:5) HMDB
Phosphatidylcholine(18:4/20:1) HMDB
Phosphatidylcholine(18:4n3/20:1n9) HMDB
Phosphatidylcholine(18:4w3/20:1w9) HMDB
Phosphatidylcholine(38:5) HMDB
Manual Xrefs Databases
HMDB0008242 HMDB
Lecithin Wikipedia
PHOSPHATIDYLCHOLINE MetaCyc
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Citation Waiting for Citations Type Source
24023812 PubMed citation Europe PMC