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Chelidamic acid

CAT: 1410-M20536-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M20536-02Size:1 mL x 10 mM in DMSO
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Description
Chelidamic acid is a heterocyclic organic acid with a pyran skeleton. Chelidamic acid is inhibitors of glutamate decarboxylase with a Ki of 33 μM.
CAS Number
138-60-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
183.12
Molecular Formula
C7H5NO5
Notes
Research use only, not for human use.
Receptor
Glutamate Transporters

Chemical Information

Chelidamic Acid
CAS Number138-60-3
PubChem CID8743
IUPAC Name4-oxo-1H-pyridine-2,6-dicarboxylic acid
Molecular FormulaC7H5NO5
Molecular Weight183.12
XLogP-0.4
Topological Polar Surface Area104
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity320
SMILES
C1=C(NC(=CC1=O)C(=O)O)C(=O)O
InChI
InChI=1S/C7H5NO5/c9-3-1-4(6(10)11)8-5(2-3)7(12)13/h1-2H,(H,8,9)(H,10,11)(H,12,13)
InChIKey
XTLJJHGQACAZMS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chelidamic Acid
CAS: 138-60-3
CID: 8743
Formula: C7H5NO5
MW: 183.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight183.12
XLogP3-0.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass183.01677226
Monoisotopic Mass183.01677226
Topological Polar Surface Area104 Ų
Heavy Atom Count13
Formal Charge0
Complexity320
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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