Structure Database (LMSD)
Common Name
Lavoisieric acid
Systematic Name
25Z-triacontenoic acid
Synonyms
- C30:1n-5
3D model of Lavoisieric 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
Filter by species:
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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.
Click on an edge to display the reaction(s).
References
String Representations
InChiKey (Click to copy)
WDKCWZUNDVUPLA-WAYWQWQTSA-N
InChi (Click to copy)
InChI=1S/C30H58O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30(31)32/h5-6H,2-4,7-29H2,1H3,(H,31,32)/b6-5-
SMILES (Click to copy)
C(CCCCCCCCCCCCCCCCCCCCCCC/C=C\CCCC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
32
Rings
Aromatic Rings
Rotatable Bonds
27
Van der Waals Molecular Volume
539.86
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
10.79
Molar Refractivity
142.49
Admin
Created at
20th Jul 2023
Updated at
20th Jul 2023