CHEBI:86127 - 1-[(9Z,12Z,15Z)-octadecatrienoyl]-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine

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ChEBI Name 1-[(9Z,12Z,15Z)-octadecatrienoyl]-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine ChEBI ID CHEBI:86127 ChEBI ASCII Name 1-[(9Z,12Z,15Z)-octadecatrienoyl]-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine Definition A phosphatidylcholine 36:4 in which the acyl groups specified at positions 1 and 2 are (9Z,12Z,15Z)-octadecatrienoyl and (9Z)-octadecenoyl respectively. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C44H80NO8P Net Charge 0 Average Mass 782.08170 Monoisotopic Mass 781.56216 InChI InChI=1S/C44H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14,16,20-23,42H,6-7,9,11-13,15,17-19,24-41H2,1-5H3/b10-8-,16-14-,22-20-,23-21-/t42-/m1/s1 InChIKey LPDGUCIMNBNWEJ-BXZVQSHESA-N SMILES CCCCCCCC\C=C/CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC\C=C/C\C=C/C\C=C/CC)COP([O-])(=O)OCC[N+](C)(C)C Roles Classification Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). (via phosphatidylcholine 36:4 ) View more via ChEBI Ontology ChEBI Ontology Outgoing 1-[(9Z,12Z,15Z)-octadecatrienoyl]-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:86127) has functional parent α-linolenic acid (CHEBI:27432) 1-[(9Z,12Z,15Z)-octadecatrienoyl]-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:86127) has functional parent oleic acid (CHEBI:16196) 1-[(9Z,12Z,15Z)-octadecatrienoyl]-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:86127) is a phosphatidylcholine 36:4 (CHEBI:64520) IUPAC Name (2R)-3-{[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy}-2-{[(9Z)-octadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate Synonyms Sources 1-alpha-Linolenoyl-2-oleoyl-sn-glycero-3-phosphocholine HMDB GPCho(18:3/18:1) HMDB GPCho(18:3n3/18:1n9) HMDB GPCho(18:3w3/18:1w9) HMDB PC(18:3(9Z,12Z,15Z)/18:1(9Z)) LIPID MAPS PC(18:3/18:1) HMDB PC(18:3n3/18:1n9) HMDB PC(18:3w3/18:1w9) HMDB Phosphatidylcholine(18:3/18:1) HMDB Phosphatidylcholine(18:3n3/18:1n9) HMDB Phosphatidylcholine(18:3w3/18:1w9) HMDB Manual Xrefs Databases HMDB0008203 HMDB LMGP01010955 LIPID MAPS View more database links Last Modified 23 October 2015