CHEBI:77753 - 1-palmitoyl-2-[(10E)-9-hydroperoxyoctadecenoyl]-sn-glycero-3-phosphocholine

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 1-palmitoyl-2-[(10E)-9-hydroperoxyoctadecenoyl]-sn-glycero-3-phosphocholine ChEBI ID CHEBI:77753 ChEBI ASCII Name 1-palmitoyl-2-[(10E)-9-hydroperoxyoctadecenoyl]-sn-glycero-3-phosphocholine Definition A 1,2-diacyl-sn-glycero-3-phosphocholine in which 1 and 2-acyl groups are specified as palmitoyl (hexadecanoyl) and (10E)-9-hydroperoxyoctadecenoyl respectively. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel 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 C42H82NO10P Net Charge 0 Average Mass 792.07490 Monoisotopic Mass 791.56763 InChI InChI=1S/C42H82NO10P/c1-6-8-10-12-14-15-16-17-18-19-21-25-29-33-41(44)49-37-40(38-51-54(47,48)50-36-35-43(3,4)5)52-42(45)34-30-26-22-24-28-32-39(53-46)31-27-23-20-13-11-9-7-2/h27,31,39-40H,6-26,28-30,32-38H2,1-5H3,(H-,46,47,48)/b31-27+/t39?,40-/m1/s1 InChIKey PZGLXPVJRAJRPD-QGTBWRAMSA-N SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC(OO)\C=C\CCCCCCC ChEBI Ontology Outgoing 1-palmitoyl-2-[(10E)-9-hydroperoxyoctadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:77753) has functional parent 9-hydroperoxy-10E-octadecenoic acid (CHEBI:85587) 1-palmitoyl-2-[(10E)-9-hydroperoxyoctadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:77753) has functional parent hexadecanoic acid (CHEBI:15756) 1-palmitoyl-2-[(10E)-9-hydroperoxyoctadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:77753) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643) 1-palmitoyl-2-[(10E)-9-hydroperoxyoctadecenoyl]-sn-glycero-3-phosphocholine (CHEBI:77753) is a oxidized glycerophosphocholine zwitterion (CHEBI:167115) IUPAC Name (2R)-3-(hexadecanoyloxy)-2-{[(10E)-9-hydroperoxyoctadec-10-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate Synonyms Sources 1-hexadecanoyl-2-(9-hydroperoxy-10E-octadecenoyl)-sn -glycero-3-phosphocholine SUBMITTER 1-hexadecanoyl-2-[(10E)-9-hydroperoxyoctadecenoyl]-sn-glycero-3-phosphocholine ChEBI 1-hexadecanoyl-2-[9-hydroperoxy-(10E-octadecenoyl)]-sn-glycero-3-phosphocholine UniProt Citation Type Source 17090529 PubMed citation SUBMITTER Last Modified 25 August 2015