Structure Database (LMSD)

Common Name
Eicosanoyl-EA
Systematic Name
N-eicosanoyl-ethanolamine
Synonyms
  • N-eicosanoylethanolamine
LM ID
LMFA08040038
Status
Active
Exact Mass
Calculate m/z
355.345029
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)
AUJVQJHODMISJP-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C22H45NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h24H,2-21H2,1H3,(H,23,25)
SMILES (Click to copy)
C(CCCCCCCCCCC)CCCCCCCC(=O)NCCO

References

Other Databases

CHEBI ID
PubChem CID
SwissLipids ID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 0
Aromatic Rings 0
Rotatable Bonds 20
Van der Waals Molecular Volume 415.10
Topological Polar Surface Area 49.33
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 2
logP 6.71
Molar Refractivity 109.86

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Created at
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Updated at
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