Structure Database (LMSD)
Common Name
DL-Acetylcarnitine
Systematic Name
3-(acetyloxy)-4-(trimethylazaniumyl)butanoate
Synonyms
- Acetylcarnitine
- Acetyl-DL-carnitine
3D model of DL-Acetylcarnitine
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)
RDHQFKQIGNGIED-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C9H17NO4/c1-7(11)14-8(5-9(12)13)6-10(2,3)4/h8H,5-6H2,1-4H3
SMILES (Click to copy)
C([N+](C)(C)C)C(OC(C)=O)CC([O-])=O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
14
Rings
0
Aromatic Rings
0
Rotatable Bonds
6
Van der Waals Molecular Volume
205.14
Topological Polar Surface Area
66.43
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
logP
-0.66
Molar Refractivity
49.77
Admin
Created at
-
Updated at
25th Apr 2022