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CHEBI:132278 - 1-O-[(9S,10R)-epoxystearoyl]-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:132278
ChEBI Name1-O-[(9S,10R)-epoxystearoyl]-sn-glycero-3-phosphocholine
Stars
ASCII Name1-O-[(9S,10R)-epoxystearoyl]-sn-glycero-3-phosphocholine
DefinitionAn lysophosphatidylcholine derived from epoxidation across the double bond of 1-O-oleoyl-sn-glycero-3-phosphocholine.
Last Modified19 October 2016
Submitternhn
DownloadsMolfile
FormulaC26H52NO8P
Net Charge0
Average Mass537.675
Monoisotopic Mass537.34305
SMILESCCCCCCCC[C@H]1O[C@H]1CCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C26H52NO8P/c1-5-6-7-8-10-13-16-24-25(35-24)17-14-11-9-12-15-18-26(29)32-21-23(28)22-34-36(30,31)33-20-19-27(2,3)4/h23-25,28H,5-22H2,1-4H3/t23-,24-,25+/m1/s1
InChIKeyUURNKRUZAWHJOR-SDHSZQHLSA-N
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-O-[(9S,10R)-epoxystearoyl]-sn-glycero-3-phosphocholine (CHEBI:132278) is a 1-O-acyl-sn-glycero-3-phosphocholine (CHEBI:58168)
1-O-[(9S,10R)-epoxystearoyl]-sn-glycero-3-phosphocholine (CHEBI:132278) is a lysophosphatidylcholine 18:0 (CHEBI:64561)
1-O-[(9S,10R)-epoxystearoyl]-sn-glycero-3-phosphocholine (CHEBI:132278) is a oxidized 1-acyl-sn-glycero-3-phosphocholine zwitterion (CHEBI:167116)
IUPAC Name 
(2R)-2-hydroxy-3-({8-[(2S,3R)-3-octyloxiran-2-yl]octanoyl}oxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
1-[(9S,10R)-epoxyoctadecanoyl]-sn-glycero-3-phosphocholineChEBI
1-[(9S,10R)-octadecanoyl]-sn-glycero-3-phosphocholineChEBI
1-[(9S,10R)-epoxystearoyl]-sn-glycero-3-phosphocholineChEBI
UniProt Name  Source
1-[(9S,10R)-epoxy-octadecanoyl]-sn-glycero-3-phosphocholineUniProt
Citations