Structure Database (LMSD)
Common Name
2E,6Z-decadienoic acid
Systematic Name
2E,6Z-decadienoic acid
Synonyms
- trans-2, cis-6-decadienoic acid
- C10:2n-4,8
3D model of 2E,6Z-decadienoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Reactions
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Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
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String Representations
InChiKey (Click to copy)
GTVXSZWUQLCDFX-FTGFODROSA-N
InChi (Click to copy)
InChI=1S/C10H16O2/c1-2-3-4-5-6-7-8-9-10(11)12/h4-5,8-9H,2-3,6-7H2,1H3,(H,11,12)/b5-4-,9-8+
SMILES (Click to copy)
C(=C/CCC)/CC/C=C/C(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
12
Rings
0
Aromatic Rings
0
Rotatable Bonds
6
Van der Waals Molecular Volume
191.22
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
2.76
Molar Refractivity
50.06
Admin
Created at
-
Updated at
25th Apr 2022