Structure Database (LMSD)
Common Name
Undecanoylcarnitine
Systematic Name
4-(trimethylazaniumyl)-3-(undecanoyloxy)butanoate
Synonyms
3D model of Undecanoylcarnitine
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Reactions
Filter by species:
ⓘ
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.
Click on an edge to display the reaction(s).
String Representations
InChiKey (Click to copy)
FPUYBGZEWPJSDX-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C18H35NO4/c1-5-6-7-8-9-10-11-12-13-18(22)23-16(14-17(20)21)15-19(2,3)4/h16H,5-15H2,1-4H3
SMILES (Click to copy)
C(C[N+](C)(C)C)(OC(=O)CCCCCCCCCC)CC(=O)[O-]
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
23
Rings
0
Aromatic Rings
0
Rotatable Bonds
15
Van der Waals Molecular Volume
360.84
Topological Polar Surface Area
66.43
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
logP
2.85
Molar Refractivity
91.32
Admin
Created at
-
Updated at
25th Apr 2022