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Acetoacetic acid sodium

CAT: 1568-C04211Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1568-C04211Size:5 mg
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CAS Number
623-58-5
SKU
C04211-5mg
Additionnal Information
Acetoacetic acid sodium is an oxidative stress inducer that acts via reducing the mRNA expression and activities of antioxidant enzymes (SOD, CAT, GSH-Px) and increasing malondialdehyde (MDA) levels. It is a signaling molecule that may influence very low density lipoprotein (VLDL) assembly in bovine hepatocytes and contribute to the development of human diabetes.

Chemical Information

Sodium acetoacetate
CAS Number623-58-5
PubChem CID23678750
IUPAC Namesodium 3-oxobutanoate
Molecular FormulaC4H5NaO3
Molecular Weight124.07
Topological Polar Surface Area57.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity99
SMILES
CC(=O)CC(=O)[O-].[Na+]
InChI
InChI=1S/C4H6O3.Na/c1-3(5)2-4(6)7;/h2H2,1H3,(H,6,7);/q;+1/p-1
InChIKey
UAKCMIIOSJFOTD-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sodium acetoacetate
CAS: 623-58-5
CID: 23678750
Formula: C4H5NaO3
MW: 124.07
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight124.07
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass124.01363830
Monoisotopic Mass124.01363830
Topological Polar Surface Area57.2 Ų
Heavy Atom Count8
Formal Charge0
Complexity99.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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A21621-25Acetoacetic acid sodium salt 25mg
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A21621-100Acetoacetic acid sodium salt 100mg
A21621-10Acetoacetic acid sodium salt 10mg
A21621-5Acetoacetic acid sodium salt 5mg

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