Structure Database (LMSD)

Common Name
N-methyl-2-oxoglutaramic acid
Systematic Name
5-(methylamino)-2,5-dioxopentanoic acid
Synonyms
  • -
LM ID
LMFA08020196
Formula
Exact Mass
Calculate m/z
159.053159
Sum Composition
Status
Active

Classification

String Representations

InChiKey (Click to copy)
MOIJYNHJLPUMNX-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C6H9NO4/c1-7-5(9)3-2-4(8)6(10)11/h2-3H2,1H3,(H,7,9)(H,10,11)
SMILES (Click to copy)
OC(C(=O)CCC(=O)NC)=O

Other Databases

KEGG ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 11
Rings 0
Aromatic Rings 0
Rotatable Bonds 4
Van der Waals Molecular Volume 150.60
Topological Polar Surface Area 83.47
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
logP -0.83
Molar Refractivity 35.94

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Created at
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Updated at
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