EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:28468 - 1-O-palmitoyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:28468
ChEBI Name1-O-palmitoyl-sn-glycero-3-phosphocholine
Stars
ASCII Name1-O-palmitoyl-sn-glycero-3-phosphocholine
DefinitionAn sn-glycero-3-phosphocholine compound having a palmitoyl substituent at the 1-hydroxy position
Secondary ChEBI IDsCHEBI:665, CHEBI:19080
Last Modified7 February 2018
DownloadsMolfile
FormulaC24H51NO7P
Net Charge+1
Average Mass496.646
Monoisotopic Mass496.33977
SMILESCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OCC[N+](C)(C)C
InChIInChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3/p+1/t23-/m1/s1
InChIKeyASWBNKHCZGQVJV-HSZRJFAPSA-O
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-O-palmitoyl-sn-glycero-3-phosphocholine (CHEBI:28468) has functional parent glycerol (CHEBI:17754)
1-O-palmitoyl-sn-glycero-3-phosphocholine (CHEBI:28468) is a 1-O-acyl-sn-glycero-3-phosphocholine(1+) (CHEBI:17504)
IUPAC Name 
(7R)-4,7-dihydroxy-N,N,N-trimethyl-10-oxo-3,5,9-trioxa-4-phosphapentacosan-1-aminium 4-oxide
Synonyms  Source
1-PalmitoylglycerophosphocholineKEGG COMPOUND
1-Palmitoyl-sn-glycero-3-phosphocholineKEGG COMPOUND
1-palmitoyl-2-lyso-sn-glycero-3-PCChEBI
GPCho(16:0/0:0)ChEBI
GPCho 16:0/0:0ChEBI
Manual XrefsDatabases
C04102KEGG COMPOUND
Registry NumbersSources
Beilstein:10046330Beilstein
Reaxys:3573387Reaxys
Citations