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CHEBI:72744 - 1-hexadecyl-2-hexadecanoyl-sn-glycero-3-phosphocholine

Default Structure
ChEBI IDCHEBI:72744
ChEBI Name1-hexadecyl-2-hexadecanoyl-sn-glycero-3-phosphocholine
Stars
ASCII Name1-hexadecyl-2-hexadecanoyl-sn-glycero-3-phosphocholine
DefinitionA 2-acyl-1-alkyl-sn-glycero-3-phosphocholine in which the acyl and alkyl groups are specified as hexadecanoyl (palmitoyl) and hexadecyl respectively.
Last Modified12 March 2015
Submitterabridge
DownloadsMolfile
FormulaC40H82NO7P
Net Charge0
Average Mass720.070
Monoisotopic Mass719.58289
SMILES[H][C@@](COCCCCCCCCCCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C40H82NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-35-45-37-39(38-47-49(43,44)46-36-34-41(3,4)5)48-40(42)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h39H,6-38H2,1-5H3/t39-/m1/s1
InChIKeyWOTHHEHCEYHCFE-LDLOPFEMSA-N
ChEBI Ontology
Outgoing Relation(s)
1-hexadecyl-2-hexadecanoyl-sn-glycero-3-phosphocholine (CHEBI:72744) is a 2-acyl-1-alkyl-sn-glycero-3-phosphocholine (CHEBI:36702)
IUPAC Name 
(2R)-3-(hexadecyloxy)-2-(hexadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
1-O-hexadecyl-2-O-hexadecanoyl-sn-glycero-3-phosphocholineChEBI
1-O-hexadecyl-2-O-palmitoyl-sn-glycero-3-phosphocholineChEBI
1-hexadecyl-2-palmitoyl-sn-glycero-3-phosphocholineChemIDplus
PC(O-16:0/16:0)SUBMITTER
UniProt Name  Source
1-O-hexadecyl-2-hexadecanoyl-sn-glycero-3-phosphocholineUniProt
Manual XrefsDatabases
LMGP01020029LIPID MAPS
Registry NumbersSources
Reaxys:7419980Reaxys
CAS:88587-94-4ChemIDplus