Structure Database (LMSD)
Common Name
9S,10R-Epoxy-3Z,6Z-octadecadiene
Systematic Name
9S,10R-Epoxy-3Z,6Z-octadecadiene
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of 9S,10R-Epoxy-3Z,6Z-octadecadiene
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
References
Comments
Pherobase Semiochemicals
String Representations
InChiKey (Click to copy)
CNYHVWZOWVYRKM-YNOGVTSOSA-N
InChi (Click to copy)
InChI=1S/C17H30O/c1-3-5-7-9-11-13-15-17-16(18-17)14-12-10-8-6-4-2/h4,6,10,12,16-17H,3,5,7-9,11,13-15H2,1-2H3/b6-4-,12-10-/t16-,17+/m0/s1
SMILES (Click to copy)
CCCCCCCC[C@H]1O[C@H]1C/C=C\C/C=C\C
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
1
Aromatic Rings
0
Rotatable Bonds
11
Van der Waals Molecular Volume
293.81
Topological Polar Surface Area
12.53
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
5.99
Molar Refractivity
80.87
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Created at
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Updated at
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