Products for Research Use Only

ERG240

CAT: 1410-M36020-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M36020-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
ERG240 is an inhibitor of branched-chain amino acid aminotransferase 1 (BCAT1) . ERG240 can be used for the research of rheumatoid arthritis, cancer, and bone disease.
CAS Number
1415683-79-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
166.15
Molecular Formula
C7H11NaO3
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Sodium 4-methyl-5-oxohexanoate
CAS Number1415683-79-2
PubChem CID165437314
IUPAC Namesodium 4-methyl-5-oxohexanoate
Molecular FormulaC7H11NaO3
Molecular Weight166.15
Topological Polar Surface Area57.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count11
Formal Charge0
Complexity145
SMILES
CC(CCC(=O)[O-])C(=O)C.[Na+]
InChI
InChI=1S/C7H12O3.Na/c1-5(6(2)8)3-4-7(9)10;/h5H,3-4H2,1-2H3,(H,9,10);/q;+1/p-1
InChIKey
QEQCTLAIARYMND-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sodium 4-methyl-5-oxohexanoate
CAS: 1415683-79-2
CID: 165437314
Formula: C7H11NaO3
MW: 166.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight166.15
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass166.06058849
Monoisotopic Mass166.06058849
Topological Polar Surface Area57.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity145
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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