Structure Database (LMSD)
Common Name
O-succinylcarnitine
Systematic Name
3-[(3-carboxypropanoyl)oxy]-4-(trimethylazaniumyl)butanoate
Synonyms
- 3-[(3-carboxypropanoyl)oxy]-4-(trimethylammonio)butanoate
- succinylcarnitine
LM ID
LMFA07070101
Formula
Exact Mass
Calculate m/z
261.121239
Sum Composition
Status
Curated
3D model of O-succinylcarnitine
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)
HAEVNYBCYZZDFL-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C11H19NO6/c1-12(2,3)7-8(6-10(15)16)18-11(17)5-4-9(13)14/h8H,4-7H2,1-3H3,(H-,13,14,15,16)
SMILES (Click to copy)
O(C(CCC(=O)O)=O)C(CC(=O)[O-])C[N+](C)(C)C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
254.68
Topological Polar Surface Area
103.73
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
logP
-0.82
Molar Refractivity
60.96
Admin
Created at
-
Updated at
25th Apr 2022