Structure Database (LMSD)

O O
Common Name
Palmityl palmitate
Systematic Name
hexadecanyl hexadecanoate
Synonyms
  • WE(16:0/16:0)
  • hexadecyl hexadecanoate
LM ID
LMFA07010001
Formula
C32H64O2
Exact Mass
Calculate m/z
480.49063
Sum Composition
WE 32:0
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty esters [FA07]
Wax monoesters [FA0701]

String Representations

InChiKey (Click to copy)
PXDJXZJSCPSGGI-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C32H64O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-32(33)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-31H2,1-2H3
SMILES (Click to copy)
CCCCCCCCCCCCCCCC(OCCCCCCCCCCCCCCCC)=O

References

Other Databases

Wikipedia
Cetyl_palmitate
KEGG ID
C13821
CHEBI ID
75584
PubChem CID
10889
SwissLipids ID
SLM:000389263

Calculated Physicochemical Properties

Heavy Atoms 34
Rings 0
Aromatic Rings 0
Rotatable Bonds 30
Van der Waals Molecular Volume 577.10
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 11.78
Molar Refractivity 152.07

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Created at
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Updated at
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