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CHEBI:75936 - 1-O-palmityl-2-acetyl-sn-glycerol

Default Structure
ChEBI IDCHEBI:75936
ChEBI Name1-O-palmityl-2-acetyl-sn-glycerol
Stars
ASCII Name1-O-palmityl-2-acetyl-sn-glycerol
DefinitionA 1-alkyl-2-acetylglycerol in which the 1-alkyl group is specified as palmityl (hexadecyl).
Last Modified27 January 2022
Submitterlaimo
DownloadsMolfile
FormulaC21H42O4
Net Charge0
Average Mass358.563
Monoisotopic Mass358.30831
SMILESCCCCCCCCCCCCCCCCOC[C@H](CO)OC(C)=O
InChIInChI=1S/C21H42O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-19-21(18-22)25-20(2)23/h21-22H,3-19H2,1-2H3/t21-/m0/s1
InChIKeyQTEHGUUSIIWOOW-NRFANRHFSA-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-palmityl-2-acetyl-sn-glycerol (CHEBI:75936) has functional parent acetic acid (CHEBI:15366)
1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936) is a 1-alkyl-2-acetyl-sn-glycerol (CHEBI:16291)
1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936) is a 1-alkyl-2-acetylglycerol (CHEBI:75882)
Incoming Relation(s)
1-hexadecyl-2-acetyl-3-decanoyl-sn-glycerol (CHEBI:77679) has functional parent 1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936)
1-palmityl-2-acetyl-3-capryloyl-sn-glycerol (CHEBI:77682) has functional parent 1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936)
1-palmityl-2-acetyl-3-lauroyl-sn-glycerol (CHEBI:77681) has functional parent 1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936)
1-palmityl-2-acetyl-3-linoleoyl-sn-glycerol (CHEBI:77676) has functional parent 1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936)
1-palmityl-2-acetyl-3-myristoyl-sn-glycerol (CHEBI:77678) has functional parent 1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936)
1-palmityl-2-acetyl-3-oleoyl-sn-glycerol (CHEBI:76055) has functional parent 1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936)
1-palmityl-2-acetyl-3-palmitoyl-sn-glycerol (CHEBI:77680) has functional parent 1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936)
1-palmityl-2-acetyl-3-stearoyl-sn-glycerol (CHEBI:77677) has functional parent 1-O-palmityl-2-acetyl-sn-glycerol (CHEBI:75936)
IUPAC Name 
(2S)-1-(hexadecyloxy)-3-hydroxypropan-2-yl acetate
Synonym  Source
DG(O-16:0/2:0/0:0)SUBMITTER
UniProt Name  Source
1-O-hexadecyl-2-acetyl-sn-glycerolUniProt
Registry NumbersSources
Reaxys:4456114Reaxys
Citations