Structure Database (LMSD)

Common Name
3Z,6Z,9Z-Eicosatriene
Systematic Name
3Z,6Z,9Z-Eicosatriene
Synonyms
LM ID
LMFA11000163
Formula
C20H36
Exact Mass
Calculate m/z
276.2817
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Hydrocarbons [FA11]

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
NVTCVZWCSVASGC-JTBMWNAQSA-N
InChi (Click to copy)
InChI=1S/C20H36/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19H,3-4,6,8-10,12,14-16,18,20H2,1-2H3/b7-5-,13-11-,19-17-
SMILES (Click to copy)
CC/C=C\C/C=C\C/C=C\CCCCCCCCCC

Other Databases

CHEBI ID
188078
PubChem CID
13116576

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 346.64
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 7.38
Molar Refractivity 94.17

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Updated at
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