Structure Database (LMSD)
Common Name
(+) Germacrene A
Systematic Name
Synonyms
3D model of (+) Germacrene A
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)
XMRKUJJDDKYUHV-DFSVIBJJSA-N
InChi (Click to copy)
InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9,15H,1,5,7-8,10-11H2,2-4H3/b13-6+,14-9+/t15-/m1/s1
SMILES (Click to copy)
C1C=C(C)CC[C@@H](C(C)=C)CC=C(C)C1
References
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
1
Aromatic Rings
0
Rotatable Bonds
1
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
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Created at
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Updated at
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