Structure Database (LMSD)
Common Name
Arachidyl carnitine
Systematic Name
3-(icosanoyloxy)-4-(trimethylazaniumyl)butanoate
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of Arachidyl carnitine
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
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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String Representations
InChiKey (Click to copy)
SVJLJQBGUITFLI-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C27H53NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27(31)32-25(23-26(29)30)24-28(2,3)4/h25H,5-24H2,1-4H3
SMILES (Click to copy)
C(=O)([O-])CC(OC(=O)CCCCCCCCCCCCCCCCCCC)C[N+](C)(C)C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
32
Rings
0
Aromatic Rings
0
Rotatable Bonds
24
Van der Waals Molecular Volume
516.54
Topological Polar Surface Area
66.43
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
logP
6.36
Molar Refractivity
132.87
Admin
Created at
-
Updated at
25th Apr 2022