CHEBI:89699 - PC(18:1(11Z)/22:2(13Z,16Z))

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name PC(18:1(11Z)/22:2(13Z,16Z)) ChEBI ID CHEBI:89699 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C48H90NO8P Net Charge 0 Average Mass 840.206 Monoisotopic Mass 839.64041 InChI InChI=1S/C48H90NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-39-41-48(51)57-46(45-56-58(52,53)55-43-42-49(3,4)5)44-54-47(50)40-38-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h14,16-17,19-20,22,46H,6-13,15,18,21,23-45H2,1-5H3/b16-14-,19-17-,22-20-/t46-/m1/s1 InChIKey XNHCNUBXMMIUNS-IMLSBYECSA-N SMILES C([C@@](COC(CCCCCCCCC/C=C\CCCCCC)=O)(OC(CCCCCCCCCCC/C=C\C/C=C\CCCCC)=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 ChEBI Ontology Outgoing PC(18:1(11Z)/22:2(13Z,16Z)) (CHEBI:89699) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643) Synonyms Sources (2-{[(2R)-2-[(13Z,16Z)-docosa-13,16-dienoyloxy]-3-[(11Z)-octadec-11-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium HMDB 1-Vaccenoyl-2-docosadienoyl-sn-glycero-3-phosphocholine HMDB GPCho(18:1/22:2) HMDB GPCho(18:1n7/22:2n6) HMDB GPCho(18:1w7/22:2w6) HMDB GPCho(40:3) HMDB Lecithin HMDB PC aa C40:3 HMDB PC(18:1/22:2) HMDB PC(18:1n7/22:2n6) HMDB PC(18:1w7/22:2w6) HMDB PC(40:3) HMDB Phosphatidylcholine(18:1/22:2) HMDB Phosphatidylcholine(18:1n7/22:2n6) HMDB Phosphatidylcholine(18:1w7/22:2w6) HMDB Phosphatidylcholine(40:3) HMDB Manual Xrefs Databases HMDB0008086 HMDB Lecithin Wikipedia PHOSPHATIDYLCHOLINE MetaCyc View more database links Citation Type Source 24023812 PubMed citation Europe PMC