Structure Database (LMSD)
Common Name
4Z,7Z,10Z,13Z,16Z,19Z,22Z,25Z-octacosaoctaenoic acid
Systematic Name
4Z,7Z,10Z,13Z,16Z,19Z,22Z,25Z-octacosaoctaenoic acid
Synonyms
- C28:8n-3,6,9,12,15,18,21,24
3D model of 4Z,7Z,10Z,13Z,16Z,19Z,22Z,25Z-octacosaoctaenoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
SOQKXJABGLKWQX-QNEHAWMZSA-N
InChi (Click to copy)
InChI=1S/C28H40O2/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/h3-4,6-7,9-10,12-13,15-16,18-19,21-22,24-25H,2,5,8,11,14,17,20,23,26-27H2,1H3,(H,29,30)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-,22-21-,25-24-
SMILES (Click to copy)
C(CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)(=O)O
References
Calculated Physicochemical Properties
Heavy Atoms
30
Rings
0
Aromatic Rings
0
Rotatable Bonds
18
Van der Waals Molecular Volume
486.78
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
8.44
Molar Refractivity
132.60
Reactions
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Admin
Created at
-
Updated at
25th Apr 2022