Structure Database (LMSD)

Common Name
7Z-Eicosen-11-one
Systematic Name
7Z-Eicosen-11-one
Synonyms
LM ID
LMFA12000210
Status
Active
Exact Mass
Calculate m/z
294.292265
Formula
C20H38O
Show lipids differing only in stereochemistry/bond geometry
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MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Oxygenated hydrocarbons [FA12]

String Representations

InChiKey (Click to copy)
HVUBXNQWXJBVHB-SQFISAMPSA-N
InChi (Click to copy)
InChI=1S/C20H38O/c1-3-5-7-9-11-13-15-17-19-20(21)18-16-14-12-10-8-6-4-2/h13,15H,3-12,14,16-19H2,1-2H3/b15-13-
SMILES (Click to copy)
CCCCCC/C=C\CCC(=O)CCCCCCCCC

References

Other Databases

CHEBI ID
179667
PubChem CID
10870139

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 0
Aromatic Rings 0
Rotatable Bonds 16
Van der Waals Molecular Volume 358.07
Topological Polar Surface Area 17.07
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 7.00
Molar Refractivity 94.75

Admin

Created at
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Updated at
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