Structure Database (LMSD)

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

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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