Structure Database (LMSD)

Common Name
2-hydroxyglutaric acid
Systematic Name
2-oxidanylpentanedioic acid
Synonyms
  • 2-hydroxyglutaric acid
LM ID
LMFA01050483
Status
Active
Exact Mass
Calculate m/z
148.037175
Formula
Abbrev



Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
HWXBTNAVRSUOJR-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C5H8O5/c6-3(5(9)10)1-2-4(7)8/h3,6H,1-2H2,(H,7,8)(H,9,10)
SMILES (Click to copy)
OC(C(=O)O)CCC(=O)O

References

Other Databases

KEGG ID
HMDB ID
CHEBI ID
PubChem CID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 10
Rings 0
Aromatic Rings 0
Rotatable Bonds 4
Van der Waals Molecular Volume 133.73
Topological Polar Surface Area 94.83
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
logP -0.42
Molar Refractivity 31.02

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Created at
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Updated at
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