Structure Database (LMSD)

Common Name
1,6Z,9Z-Heptadecatriene
Systematic Name
1,6Z,9Z-Heptadecatriene
Synonyms
LM ID
LMFA11000126
Formula
C17H30
Exact Mass
Calculate m/z
234.23475
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)
WROSSQPPNOJBLO-BIXSNLIQSA-N
InChi (Click to copy)
InChI=1S/C17H30/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3,11,13,16-17H,1,4-10,12,14-15H2,2H3/b13-11-,17-16-
SMILES (Click to copy)
C=CCCC/C=C\C/C=C\CCCCCCC

Other Databases

CHEBI ID
192859
PubChem CID
56936104

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 294.74
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 6.21
Molar Refractivity 80.32

Admin

Created at
-
Updated at
-