CHEBI:77677 - 1-palmityl-2-acetyl-3-stearoyl-sn-glycerol

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ChEBI Name 1-palmityl-2-acetyl-3-stearoyl-sn-glycerol
ChEBI ID CHEBI:77677
ChEBI ASCII Name 1-palmityl-2-acetyl-3-stearoyl-sn-glycerol
Definition A 1-alkyl-2-acetyl-3-acyl-sn-glycerol in which the alkyl and acyl groups are specified as palmityl and stearoyl.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Supplier Information
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Formula C39H76O5
Net Charge 0
Average Mass 625.01770
Monoisotopic Mass 624.56928
InChI InChI=1S/C39H76O5/c1-4-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-39(41)43-36-38(44-37(3)40)35-42-34-32-30-28-26-24-22-19-17-15-13-11-9-7-5-2/h38H,4-36H2,1-3H3/t38-/m1/s1
InChIKey FDYFIYWWDYCAEH-KXQOOQHDSA-N
SMILES CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COCCCCCCCCCCCCCCCC)OC(C)=O
ChEBI Ontology
Outgoing 1-palmityl-2-acetyl-3-stearoyl-sn-glycerol (CHEBI:77677) 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 octadecanoic acid (CHEBI:28842)
1-palmityl-2-acetyl-3-stearoyl-sn-glycerol (CHEBI:77677) is a 1-alkyl-2-acetyl-3-acyl-sn-glycerol (CHEBI:17473)
IUPAC Name
(2R)-2-acetoxy-3-(hexadecyloxy)propyl octadecanoate
Synonyms Sources
(2R)-2-acetoxy-3-(hexadecyloxy)propyl stearate IUPAC
1-hexadecyl-2-acetyl-3-octadecanoyl-sn-glycerol ChEBI
1-O-hexadecyl-2-acetyl-3-octadecanoyl-sn-glycerol UniProt
Last Modified
08 May 2014