Structure Database (LMSD)

Common Name
Pyruvic acid
Systematic Name
2-oxo-propinoic acid
Synonyms
  • alpha-keto propionic acid
LM ID
LMFA01060077
Status
Active
Exact Mass
Calculate m/z
88.016045
Formula
C3H4O3
Abbrev
FA 3:1;O
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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]
Oxo fatty acids [FA0106]

String Representations

InChiKey (Click to copy)
LCTONWCANYUPML-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C3H4O3/c1-2(4)3(5)6/h1H3,(H,5,6)
SMILES (Click to copy)
CC(=O)C(=O)O

References

Other Databases

Wikipedia
Pyruvic acid
KEGG ID
C00022
HMDB ID
HMDB0000243
CHEBI ID
32816
LIPIDBANK ID
DFA0385
PubChem CID
1060

Calculated Physicochemical Properties

Heavy Atoms 6
Rings 0
Aromatic Rings 0
Rotatable Bonds 1
Van der Waals Molecular Volume 81.55
Topological Polar Surface Area 54.37
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
logP -0.34
Molar Refractivity 18.32

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Created at
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Updated at
14th May 2021