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CHEBI:75220 - 1-stearoyl-2-acetyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:75220
ChEBI Name1-stearoyl-2-acetyl-sn-glycero-3-phosphocholine
Stars
ASCII Name1-stearoyl-2-acetyl-sn-glycero-3-phosphocholine
DefinitionA 1,2-diacyl-sn-glycero-3-phosphocholine in which the two acyl substituents at positions 1 and 2 are specified as stearoyl and acetyl respectively.
Last Modified30 August 2013
Submitterlaimo
DownloadsMolfile
FormulaC28H56NO8P
Net Charge0
Average Mass565.729
Monoisotopic Mass565.37435
SMILESCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(C)=O
InChIInChI=1S/C28H56NO8P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-28(31)34-24-27(37-26(2)30)25-36-38(32,33)35-23-22-29(3,4)5/h27H,6-25H2,1-5H3/t27-/m1/s1
InChIKeyILLILTKBYHPOIA-HHHXNRCGSA-N
ChEBI Ontology
Outgoing Relation(s)
1-stearoyl-2-acetyl-sn-glycero-3-phosphocholine (CHEBI:75220) has functional parent acetic acid (CHEBI:15366)
1-stearoyl-2-acetyl-sn-glycero-3-phosphocholine (CHEBI:75220) has functional parent octadecanoic acid (CHEBI:28842)
1-stearoyl-2-acetyl-sn-glycero-3-phosphocholine (CHEBI:75220) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
(2R)-2-acetoxy-3-(octadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
1-octadecanoyl-2-acetyl-sn-glycero-3-phosphocholineSUBMITTER
1-octadecanoyl-2-acetyl-sn-phosphatidylcholineSUBMITTER
1-O-Octadecyl-2-O-acetyl-sn-glycero-3-phosphocholineLIPID MAPS
1-Stearoyl-2-acetyl-sn-glycero-3-phosphorylcholineLIPID MAPS
(2R)-2-acetoxy-3-(stearoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphateIUPAC
PC(18:0/2:0)SUBMITTER
UniProt Name  Source
1-octadecanoyl-2-acetyl-sn-glycero-3-phosphocholineUniProt
Manual XrefsDatabases
LMGP01010779LIPID MAPS
Registry NumbersSources
Reaxys:6493998Reaxys
CAS:79549-26-1ChemIDplus