Structure Database (LMSD)
Common Name
27:3(5Z,9Z,20Z)
Systematic Name
5Z,9Z,20Z-Heptacosatrienoic acid
Synonyms
- C27:3n-7,18,22
3D model of 27:3(5Z,9Z,20Z)
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)
DISUUZKGYKJRIF-RMOJKJCGSA-N
InChi (Click to copy)
InChI=1S/C27H48O2/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/h7-8,18-19,22-23H,2-6,9-17,20-21,24-26H2,1H3,(H,28,29)/b8-7-,19-18-,23-22-
SMILES (Click to copy)
C(CCC/C=C\CC/C=C\CCCCCCCCC/C=C\CCCCCC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
29
Rings
0
Aromatic Rings
0
Rotatable Bonds
22
Van der Waals Molecular Volume
482.68
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
9.17
Molar Refractivity
128.45
Admin
Created at
-
Updated at
25th Apr 2022