Structure Database (LMSD)
Common Name
28:4(13Z,16Z,19Z,22Z)
Systematic Name
13Z,16Z,19Z,22Z-octacosatetraenoic acid
Synonyms
- 28:4(w6)
- 28:4n6
No other lipid differing only in stereochemistry/bond geometry found
3D model of 28:4(13Z,16Z,19Z,22Z)
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
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Homo sapiens
(#9606)
Mammalia
(#40674)
Long-chain and very long-chain polyunsaturated fatty acids in ocular aging and age-related macular degeneration,
J. Lipid Res, 2010
J. Lipid Res, 2010
Pubmed ID:
20688753
DOI:
10.1194/jlr.M007518
String Representations
InChiKey (Click to copy)
LPLFLSUGEHBUTE-DOFZRALJSA-N
InChi (Click to copy)
InChI=1S/C28H48O2/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/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-27H2,1H3,(H,29,30)/b7-6-,10-9-,13-12-,16-15-
SMILES (Click to copy)
C(CCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
30
Rings
0
Aromatic Rings
0
Rotatable Bonds
22
Van der Waals Molecular Volume
497.34
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
9.34
Molar Refractivity
132.98
Admin
Created at
-
Updated at
25th Apr 2022