Structure Database (LMSD)

O HO O + N O O _ O
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
C11H19NO6
Exact Mass
Calculate m/z
261.121239
Sum Composition
CAR 4:1;O2
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty esters [FA07]
Fatty acyl carnitines [FA0707]

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

References

Other Databases

CHEBI ID
73034
PubChem CID
71464481

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

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).
Reactions graph legend

Admin

Created at
-
Updated at
25th Apr 2022