Structure Database (LMSD)

Common Name
Palmityl palmitate
Systematic Name
hexadecanyl hexadecanoate
Synonyms
  • WE(16:0/16:0)
  • hexadecyl hexadecanoate
LM ID
LMFA07010001
Status
Active
Exact Mass
Calculate m/z
480.49063
Formula
Abbrev


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

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
KEGG ID
CHEBI ID
PubChem CID
SwissLipids ID

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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