Structure Database (LMSD)

Common Name
(R)-2,3-Dihydroxy-isovalerate
Systematic Name
(2R)-2,3-dihydroxy-3-methylbutanoic acid
Synonyms
LM ID
LMFA01050453
Formula
Exact Mass
Calculate m/z
134.05791
Sum Composition
Status
Active

Main

Classification

String Representations

InChiKey (Click to copy)
JTEYKUFKXGDTEU-VKHMYHEASA-N
InChi (Click to copy)
InChI=1S/C5H10O4/c1-5(2,9)3(6)4(7)8/h3,6,9H,1-2H3,(H,7,8)/t3-/m0/s1
SMILES (Click to copy)
C(=O)(O)[C@H](O)C(C)(O)C

References

Other Databases

KEGG ID
HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 9
Rings 0
Aromatic Rings 0
Rotatable Bonds 2
Van der Waals Molecular Volume 127.58
Topological Polar Surface Area 77.76
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
logP -0.22
Molar Refractivity 30.96

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Created at
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Updated at
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