Sodium metatungstate hydrate

CAT: 0931-T208708-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-T208708-01Size:10 mg

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CAS Number

314075-43-9

Target

Pyroptosis, Phosphatase

Related Pathways

Immunology/Inflammation, Metabolism, Apoptosis

Bioactivity

Sodium metatungstate (Sodium polyoxotungstate; POM-1) hydrate is an inhibitor of NTPDase, with Ki values for NTPDase1 (CD39), NTPDase 3, and NTPDase 2 being 2.58 μM, 3.26 μM, and 28.8 μM, respectively. It exhibits anti-inflammatory and anticancer properties and inhibits ATP hydrolysis while also blocking central synaptic transmission.

Smiles

O=[W+4]1234[O-2][W+4]567([O-2][W+4]89%10([O-2][W+4]%11%12([O-2]1)([O-2][W+4]%13([O-2]8)([O-2][W+4]%14%15%16([O-2][W+4]%17([O-2]2)([O-2]%11)([O-2][W+4]%18([O-2][W+4]([O-2]3)([O-2]5)([O-2][W+4]%19%20([O-2][W+4]%21([O-2]6)([O-2]9)([O-2][W+4]([O-2]%13)([O-2]%14)([O-2]%19)([OH-]%21%20)=O)=O)([O-2]%18)=O)([O-2]47)=O)([O-2]%15)([OH-]%17%16)=O)=O)=O)([O-2]%12%10)=O)=O)=O)=O.[Na+].O.[Na+].[Na+].[Na+].[Na+].[Na+]

Molecular Formula

H4Na6O41W12

Molecular Weight

3004.01

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Hexasodium dihydrogen-dodecawolframate

CAS Number	314075-43-9
PubChem CID	16212387
IUPAC Name	hexasodium;hydroxy-[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungsten;bis(hydroxy-[[(oxido(dioxo)tungstenio)oxy-dioxotungstenio]oxy-dioxotungstenio]oxy-dioxotungsten);tungsten;trihydroxide;hydrate
Molecular Formula	H8Na6O40W12
Molecular Weight	2992.1
Topological Polar Surface Area	583
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	40
Rotatable Bond Count	13
Heavy Atom Count	58
Formal Charge	0
Complexity	2100

SMILES

O.[OH-].[OH-].[OH-].O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)[O-].O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)[O-].O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[W]

InChI

InChI=1S/6Na.7H2O.33O.12W/h;;;;;;7*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q6*+1;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;3*-1;;;;;;;;;;3*+1/p-6

InChIKey

ZHHYGMAYHOPMBY-UHFFFAOYSA-H

Chemical Structure

2D Structure

CAS: 314075-43-9

CID: 16212387

Formula: H8Na6O40W12

MW: 2992.1

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	2992.1
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	40
Rotatable Bond Count	13
Exact Mass	2991.20969
Monoisotopic Mass	2993.20900
Topological Polar Surface Area	583 Å²
Heavy Atom Count	58
Formal Charge	0
Complexity	2100
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	14
Compound Is Canonicalized	Yes

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466296-01	Sodium Metatungstate Hydrate
HY-103259A	Sodium metatungstate (hydrate)
A0690-01	Ammonium Metatungstate Hydrate
MBS3613064-01	Sodium metatungstate
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Sodium metatungstate hydrate

Chemical Information

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