CHEBI:89925 - PC(dm18:1(11Z)/20:4(8Z,11Z,14Z,17Z))

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name PC(dm18:1(11Z)/20:4(8Z,11Z,14Z,17Z))
ChEBI ID CHEBI:89925
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C46H82NO7P
Net Charge 0
Average Mass 792.121
Monoisotopic Mass 791.58289
InChI InChI=1S/C46H82NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-46(48)54-45(44-53-55(49,50)52-42-40-47(3,4)5)43-51-41-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h8,10,14,16-17,19-20,22,25,27,38,41,45H,6-7,9,11-13,15,18,21,23-24,26,28-37,39-40,42-44H2,1-5H3/b10-8-,16-14-,19-17-,22-20-,27-25-,41-38-/t45-/m1/s1
InChIKey HPXHHJRUVZWLFU-BKTRUPHPSA-N
SMILES C([C@@](CO/C=C\CCCCCCCC/C=C\CCCCCC)(OC(CCCCCC/C=C\C/C=C\C/C=C\C/C=C\CC)=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(dm18:1(11Z)/20:4(8Z,11Z,14Z,17Z)) (CHEBI:89925) is a glycerophosphocholine (CHEBI:36313)
Synonyms Sources
(2-{[(2R)-2-[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyloxy]-3-[(1Z,11Z)-octadeca-1,11-dien-1-yloxy]propyl phosphonato]oxy}ethyl)trimethylazanium HMDB
1-(1-Enyl-vaccenoyl)-2-eicsoate HMDB
1-(1-Enyl-vaccenoyl)-2-eicsoatetraenoyl-sn-glycero-3-phosphocholine HMDB
1-(1-Enyl-vaccenoyl)-2-eicsoic acid HMDB
GPCho(18:1/20:4) HMDB
GPCho(18:1n7/20:4n3) HMDB
GPCho(18:1w7/20:4w3) HMDB
GPCho(38:5) HMDB
Lecithin HMDB
PC aa C38:5 HMDB
PC(18:1/20:4) HMDB
PC(18:1n7/20:4n3) HMDB
PC(18:1w7/20:4w3) HMDB
PC(38:5) HMDB
Phosphatidylcholine(18:1/20:4) HMDB
Phosphatidylcholine(18:1n7/20:4n3) HMDB
Phosphatidylcholine(18:1w7/20:4w3) HMDB
Phosphatidylcholine(38:5) HMDB
Manual Xref Database
HMDB0011287 HMDB
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Citation Waiting for Citations Type Source
24023812 PubMed citation Europe PMC