CHEBI:89931 - PC(P-18:1(11Z)/18:4(6Z,9Z,12Z,15Z))

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name PC(P-18:1(11Z)/18:4(6Z,9Z,12Z,15Z))
ChEBI ID CHEBI:89931
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C44H78NO7P
Net Charge 0
Average Mass 764.068
Monoisotopic Mass 763.55159
InChI InChI=1S/C44H78NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-49-41-43(42-51-53(47,48)50-40-38-45(3,4)5)52-44(46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h9,11,15-18,21,23,27,29,36,39,43H,6-8,10,12-14,19-20,22,24-26,28,30-35,37-38,40-42H2,1-5H3/b11-9-,17-15-,18-16-,23-21-,29-27-,39-36-/t43-/m1/s1
InChIKey DBMSAJFSJLCYLI-YAYDGDQKSA-N
SMILES C([C@@](CO/C=C\CCCCCCCC/C=C\CCCCCC)(OC(CCCC/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)
ChEBI Ontology
Outgoing PC(P-18:1(11Z)/18:4(6Z,9Z,12Z,15Z)) (CHEBI:89931) is a glycerophosphocholine (CHEBI:36313)
Synonyms Sources
1-(1-Enyl-vaccenoyl)-2-stearidonoyl-sn-glycero-3-phosphocholine HMDB
GPCho(18:1/18:4) HMDB
GPCho(18:1n7/18:4n3) HMDB
GPCho(18:1w7/18:4w3) HMDB
GPCho(36:5) HMDB
Lecithin HMDB
PC aa C36:5 HMDB
PC(18:1/18:4) HMDB
PC(18:1n7/18:4n3) HMDB
PC(18:1w7/18:4w3) HMDB
PC(36:5) HMDB
Phosphatidylcholine(18:1/18:4) HMDB
Phosphatidylcholine(18:1n7/18:4n3) HMDB
Phosphatidylcholine(18:1w7/18:4w3) HMDB
Phosphatidylcholine(36:5) HMDB
trimethyl(2-{[(2R)-3-[(1Z,11Z)-octadeca-1,11-dien-1-yloxy]-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyloxy]propyl phosphonato]oxy}ethyl)azanium HMDB
Manual Xref Database
HMDB0011280 HMDB
View more database links