Structure Database (LMSD)

Common Name
Anandamide (20:1, n-9)
Systematic Name
N-(11Z-eicosaenoyl)-ethanolamine
Synonyms
  • N-cis-11-eicosaenoylethanolamine
LM ID
LMFA08040010
Status
Active
Exact Mass
Calculate m/z
353.329379
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)
YDKRGMXLBRWZJR-KTKRTIGZSA-N
InChi (Click to copy)
InChI=1S/C22H43NO2/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/h9-10,24H,2-8,11-21H2,1H3,(H,23,25)/b10-9-
SMILES (Click to copy)
C(C/C=C\CCCCCCCC)CCCCCCCC(=O)NCCO

References

Other Databases

CHEBI ID
LIPIDBANK ID
XPR7010
PubChem CID
SwissLipids ID

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 0
Aromatic Rings 0
Rotatable Bonds 19
Van der Waals Molecular Volume 412.46
Topological Polar Surface Area 49.33
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
logP 6.48
Molar Refractivity 109.76

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Created at
-
Updated at
21st Apr 2020