Structure Database (LMSD)

Common Name
Succinic acid
Systematic Name
Butanedioic acid
Synonyms
  • Amber acid
  • Dihydrofumaric acid
  • Wormwood acid
LM ID
LMFA01170043
Status
Active
Exact Mass
Calculate m/z
118.02661
Formula
C4H6O4
Abbrev
FA 4:1;O2
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MDLMOL SDF CSV TSV
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Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Dicarboxylic acids [FA0117]

String Representations

InChiKey (Click to copy)
KDYFGRWQOYBRFD-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
SMILES (Click to copy)
C(CCC(=O)O)(=O)O

References

Other Databases

Wikipedia
butanedioic acid
LIPIDAT ID
8334
KEGG ID
C00042
HMDB ID
HMDB0000254
CHEBI ID
15741
PubChem CID
1110
PlantFA ID
10237
SwissLipids ID
SLM:000000892

Calculated Physicochemical Properties

Heavy Atoms 8
Rings 0
Aromatic Rings 0
Rotatable Bonds 3
Van der Waals Molecular Volume 107.64
Topological Polar Surface Area 74.60
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
logP -0.06
Molar Refractivity 24.51

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Updated at
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