CHEBI:89601 - PC(18:2(9Z,12Z)/16:1(9Z))

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name PC(18:2(9Z,12Z)/16:1(9Z)) ChEBI ID CHEBI:89601 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 Formulae C42H78NO8P C42H78NO8P Net Charge 0 Average Mass 756.046 Monoisotopic Mass 755.54651 InChI InChI=1S/C42H78NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h14,16-17,19-21,40H,6-13,15,18,22-39H2,1-5H3/b16-14-,19-17-,21-20-/t40-/m1/s1 InChIKey PPCVNZFMCABQCL-KXESGEQTSA-N SMILES C([C@@](COC(CCCCCCC/C=C\C/C=C\CCCCC)=O)(OC(CCCCCCC/C=C\CCCCCC)=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 Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation) Roles Classification Biological Role(s): Caenorhabditis elegans metabolite A nematode metabolite produced by Caenorhabditis elegans. (via phosphatidylcholine 34:3 ) View more via ChEBI Ontology ChEBI Ontology Outgoing PC(18:2(9Z,12Z)/16:1(9Z)) (CHEBI:89601) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643) PC(18:2(9Z,12Z)/16:1(9Z)) (CHEBI:89601) is a PC(18:2/16:1) (CHEBI:138447) Synonyms Sources (2-{[(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium HMDB 1-Linoleoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine HMDB GPCho(18:2/16:1) HMDB GPCho(18:2n6/16:1n7) HMDB GPCho(18:2w6/16:1w7) HMDB GPCho(34:3) HMDB Lecithin HMDB PC aa C34:3 HMDB PC(18:2/16:1) HMDB PC(18:2n6/16:1n7) HMDB PC(18:2w6/16:1w7) HMDB PC(34:3) HMDB Phosphatidylcholine(18:2/16:1) HMDB Phosphatidylcholine(18:2n6/16:1n7) HMDB Phosphatidylcholine(18:2w6/16:1w7) HMDB Phosphatidylcholine(34:3) HMDB Manual Xrefs Databases HMDB0008134 HMDB Lecithin Wikipedia PHOSPHATIDYLCHOLINE MetaCyc View more database links Citation Type Source 24023812 PubMed citation Europe PMC Last Modified 21 September 2017