Structure Database (LMSD)
Common Name
(1Z,6E)-gamma-humulene
Systematic Name
(1Z,6E)-1,8,8-trimethyl-5-methylidenecycloundeca-1,6-diene (1Z,6E)-humula-1(11),4(13),5-triene
Synonyms
- (1Z,6E)-1,8,8-trimethyl-5-methylenecycloundeca-1,6-diene
3D model of (1Z,6E)-gamma-humulene
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
FNXUOGPQAOCFKU-RYKBTYGJSA-N
InChi (Click to copy)
InChI=1S/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h7,10,12H,2,5-6,8-9,11H2,1,3-4H3/b12-10+,13-7-
SMILES (Click to copy)
C1C(C)(C)C=CC(=C)CCC=C(C)CC1
References
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
1
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
247.78
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
5.04
Molar Refractivity
68.90
Admin
Created at
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Updated at
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