CHEBI:89947 - PC(P-18:1(11Z)/18:3(6Z,9Z,12Z))

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name PC(P-18:1(11Z)/18:3(6Z,9Z,12Z))
ChEBI ID CHEBI:89947
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C44H80NO7P
Net Charge 0
Average Mass 766.084
Monoisotopic Mass 765.56724
InChI InChI=1S/C44H80NO7P/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/h15-18,21,23,27,29,36,39,43H,6-14,19-20,22,24-26,28,30-35,37-38,40-42H2,1-5H3/b17-15-,18-16-,23-21-,29-27-,39-36-
InChIKey RWVKPDIHPPTVRQ-HWGQMOSASA-N
SMILES C(C(CO/C=C\CCCCCCCC/C=C\CCCCCC)OC(CCCC/C=C\C/C=C\C/C=C\CCCCC)=O)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(P-18:1(11Z)/18:3(6Z,9Z,12Z)) (CHEBI:89947) is a glycerophosphocholine (CHEBI:36313)
Synonyms Sources
1-(1-Enyl-vaccenoyl)-2-g-linolenoyl-sn-glycero-3-phosphocholine HMDB
1-(1-Enyl-vaccenoyl)-2-gamma-linolenoyl-sn-glycero-3-phosphocholine HMDB
GPCho(18:1/18:3) HMDB
GPCho(18:1n7/18:3n6) HMDB
GPCho(18:1w7/18:3w6) HMDB
GPCho(36:4) HMDB
Lecithin HMDB
PC aa C36:4 HMDB
PC(18:1/18:3) HMDB
PC(18:1n7/18:3n6) HMDB
PC(18:1w7/18:3w6) HMDB
PC(36:4) HMDB
Phosphatidylcholine(18:1/18:3) HMDB
Phosphatidylcholine(18:1n7/18:3n6) HMDB
Phosphatidylcholine(18:1w7/18:3w6) HMDB
Phosphatidylcholine(36:4) HMDB
trimethyl[2-({3-[(1Z,11Z)-octadeca-1,11-dien-1-yloxy]-2-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl phosphonato}oxy)ethyl]azanium HMDB
Manual Xref Database
HMDB0011278 HMDB
View more database links
Citation Waiting for Citations Type Source
24023812 PubMed citation Europe PMC