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CHEBI:77726 - 1-decanoyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:77726
ChEBI Name1-decanoyl-sn-glycero-3-phosphocholine
Stars
ASCII Name1-decanoyl-sn-glycero-3-phosphocholine
DefinitionA 1-O-acyl-sn-glycero-3-phosphocholine in which the acyl group is specified as capryl (decanoyl).
Last Modified3 September 2015
Submitterlaimo
DownloadsMolfile
FormulaC18H38NO7P
Net Charge0
Average Mass411.476
Monoisotopic Mass411.23859
SMILESCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C18H38NO7P/c1-5-6-7-8-9-10-11-12-18(21)24-15-17(20)16-26-27(22,23)25-14-13-19(2,3)4/h17,20H,5-16H2,1-4H3/t17-/m1/s1
InChIKeySECPDKKEUKDCPG-QGZVFWFLSA-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-decanoyl-sn-glycero-3-phosphocholine (CHEBI:77726) is a 1-O-acyl-sn-glycero-3-phosphocholine (CHEBI:58168)
1-decanoyl-sn-glycero-3-phosphocholine (CHEBI:77726) is a decanoate ester (CHEBI:87658)
IUPAC Name 
(2R)-3-(decanoyloxy)-2-hydroxypropyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
1-decanoyl-sn-glycero-3-phosphocholine betaineSUBMITTER
LPC 10:0/0:0SUBMITTER
PC(10:0/0:0)LIPID MAPS
LPC(10:0/0:0)LIPID MAPS
LyPC(10:0/0:0)HMDB
Lysophosphatidylcholine(10:0)HMDB
UniProt Name  Source
1-decanoyl-sn-glycero-3-phosphocholineUniProt
Manual XrefsDatabases
LMGP01050005LIPID MAPS
HMDB0003752HMDB
Registry NumbersSources
Reaxys:5631430Reaxys