Structure Database (LMSD)
Common Name
(1Z,4E)-germacrene B
Systematic Name
(1Z,4E)-germacra-1(10),4,7(11)-triene (1Z,5E)-1,5-dimethyl-8-(propan-2-ylidene)cyclodeca-1,5-diene
Synonyms
- (1Z,5E)-8-isopropylidene-1,5-dimethylcyclodeca-1,5-diene
3D model of (1Z,4E)-germacrene B
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)
GXEGJTGWYVZSNR-LBJJKJHXSA-N
InChi (Click to copy)
InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9H,5,7-8,10-11H2,1-4H3/b13-6-,14-9+
SMILES (Click to copy)
C1C/C(=C(/C)\C)/CC=C(C)CCC=C1C
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
5.18
Molar Refractivity
68.97
Admin
Created at
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Updated at
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