Structure Database (LMSD)

Common Name
3R-hydroxy-butanoic acid
Systematic Name
3R-hydroxy-butanoic acid
Synonyms
  • Butanoic acid, 3-hydroxy-, (R)-
  • Butyric acid, 3-hydroxy-, D-(-)-
  • (-)-3-Hydroxy-n-butyric acid
  • (-)-3-Hydroxybutyric acid
  • (R)-(-)-beta-Hydroxybutyric acid
  • (R)-(-)-3-Hydroxybutyric acid
  • (R)-beta-Hydroxybutanoic acid
  • (R)-beta-Hydroxybutyric acid
  • (R)-3-
LM ID
LMFA01050243
Formula
Exact Mass
Calculate m/z
104.047345
Sum Composition
Status
Active


Classification

String Representations

InChiKey (Click to copy)
WHBMMWSBFZVSSR-GSVOUGTGSA-N
InChi (Click to copy)
InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1
SMILES (Click to copy)
C(C[C@H](O)C)(=O)O

Other Databases

LIPIDAT ID
4513
KEGG ID
HMDB ID
CHEBI ID
PubChem CID
PDB ID
GuidePharm ID

Calculated Physicochemical Properties

Heavy Atoms 7
Rings 0
Aromatic Rings 0
Rotatable Bonds 2
Van der Waals Molecular Volume 101.49
Topological Polar Surface Area 57.53
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
logP 0.13
Molar Refractivity 24.45

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Created at
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Updated at
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