Structure Database (LMSD)
Common Name
Capecchic acid
Systematic Name
11Z-heneicosenoic acid
Synonyms
- C21:1n-10
3D model of Capecchic 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)
HMQNHJJIYIZSOU-KHPPLWFESA-N
InChi (Click to copy)
InChI=1S/C21H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h10-11H,2-9,12-20H2,1H3,(H,22,23)/b11-10-
SMILES (Click to copy)
C(CCCCCCCCC/C=C\CCCCCCCCC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
23
Rings
Aromatic Rings
Rotatable Bonds
18
Van der Waals Molecular Volume
384.16
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
7.28
Molar Refractivity
100.94
Admin
Created at
26th Jul 2023
Updated at
26th Jul 2023