Structure Database (LMSD)
Common Name
9S,10R-epoxy-3Z,6Z-heptadecadiene
Systematic Name
9S,10R-epoxy-3Z,6Z-heptadecadiene
Synonyms
3D model of 9S,10R-epoxy-3Z,6Z-heptadecadiene
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)
XKXHPEFHBVBMGF-QXRKNUMISA-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/h5,7,11,13,16-17H,3-4,6,8-10,12,14-15H2,1-2H3/b7-5-,13-11-/t16-,17+/m1/s1
SMILES (Click to copy)
CC/C=C\C/C=C\C[C@@H]1O[C@@H]1CCCCCCC
Other Databases
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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