Structure Database (LMSD)

Common Name
Acetic acid
Systematic Name
ethanoic acid
Synonyms
  • Vinegar acid
  • 10.Methanecarboxylic acid
  • acetate
  • C2:0
LM ID
LMFA01010002
Formula
Exact Mass
Calculate m/z
60.02113
Sum Composition
Status
Active


Main

Classification

String Representations

InChiKey (Click to copy)
QTBSBXVTEAMEQO-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
SMILES (Click to copy)
CC(=O)O

References

Other Databases

Wikipedia
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0002
PubChem CID
PlantFA ID
SwissLipids ID
PDB ID
GuidePharm ID

Calculated Physicochemical Properties

Heavy Atoms 4
Rings 0
Aromatic Rings 0
Rotatable Bonds 0
Van der Waals Molecular Volume 58.10
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 0.09
Molar Refractivity 13.31

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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Reactions graph legend

Admin

Created at
-
Updated at
25th Apr 2022