Structure Database (LMSD)
Common Name
6S,7R-Epoxy-3Z,9Z-eicosadiene
Systematic Name
6S,7R-Epoxy-3Z,9Z-eicosadiene
Synonyms
3D model of 6S,7R-Epoxy-3Z,9Z-eicosadiene
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)
QBCBDINXYRUHGT-UIWVHOAUSA-N
InChi (Click to copy)
InChI=1S/C20H36O/c1-3-5-7-8-9-10-11-12-13-14-16-18-20-19(21-20)17-15-6-4-2/h6,14-16,19-20H,3-5,7-13,17-18H2,1-2H3/b15-6-,16-14-/t19-,20+/m1/s1
SMILES (Click to copy)
CC/C=C\C[C@H]1O[C@H]1C/C=C\CCCCCCCCCC
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
21
Rings
1
Aromatic Rings
0
Rotatable Bonds
14
Van der Waals Molecular Volume
345.71
Topological Polar Surface Area
12.53
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
7.16
Molar Refractivity
94.72
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Created at
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Updated at
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