Structure Database (LMSD)
Common Name
Menzeleic acid
Systematic Name
6Z,13Z-hexadecadienoic acid
Synonyms
- C16:2n-3,10
3D model of Menzeleic 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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References
String Representations
InChiKey (Click to copy)
JUJFDIPCFOEZKC-WXRHCNDASA-N
InChi (Click to copy)
InChI=1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h3-4,10-11H,2,5-9,12-15H2,1H3,(H,17,18)/b4-3-,11-10-
SMILES (Click to copy)
C(CCCC/C=C\CCCCC/C=C\CC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
0
Aromatic Rings
0
Rotatable Bonds
12
Van der Waals Molecular Volume
295.02
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.10
Molar Refractivity
77.76
Admin
Created at
16th Aug 2023
Updated at
16th Aug 2023