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Metamizole hemimagnesium

CAT: 0931-T206259-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T206259-01Size:10 mg
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CAS Number
6150-97-6
Target
Apoptosis, COX, Interleukin
Related Pathways
Neuroscience, Immunology/Inflammation, Apoptosis
Bioactivity
Metamizole (Dipyrone) hemimagnesium is an anti-inflammatory and antioxidant compound known for its ability to reduce fever. It decreases levels of C-reactive protein (CRP) and interleukin 6 (IL-6) . Additionally, Metamizole hemimagnesium acts as an orally active cyclooxygenase (COX) inhibitor, suppressing cell proliferation and promoting apoptosis. It is utilized in the study of inflammation and fever.
Smiles
[Mg].O=C1C(=C(N(N1C=2C=CC=CC2)C)C)N(C)CS(=O)(=O)O
Molecular Formula
C13H17MgN3O4S
Molecular Weight
335.662
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Magnesium [(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylamino]methanesulphonate
CAS Number6150-97-6
PubChem CID10326858
IUPAC Namemagnesium bis([(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-methylamino]methanesulfonate)
Molecular FormulaC26H32MgN6O8S2
Molecular Weight645.0
Topological Polar Surface Area185
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count6
Heavy Atom Count43
Formal Charge0
Complexity533
SMILES
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)CS(=O)(=O)[O-].CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)CS(=O)(=O)[O-].[Mg+2]
InChI
InChI=1S/2C13H17N3O4S.Mg/c2*1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11;/h2*4-8H,9H2,1-3H3,(H,18,19,20);/q;;+2/p-2
InChIKey
NHMUJYOBLYTIKO-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Magnesium [(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylamino]methanesulphonate
CAS: 6150-97-6
CID: 10326858
Formula: C26H32MgN6O8S2
MW: 645.0
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight645.0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count6
Exact Mass644.1573460
Monoisotopic Mass644.1573460
Topological Polar Surface Area185 Ų
Heavy Atom Count43
Formal Charge0
Complexity533
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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