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Tetrathiomolybdate

CAT: 0957-E1166-02Size: 10 mm/ 1 mLDry Ice: NoHazardous: No
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CAT#:0957-E1166-02Size:10 mm/ 1 mL
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Description
Tetrathiomolybdate (TM) is used in the clinic for the treatment of Wilson’s disease by inducing dimerization of the metal-binding domain of the cellular copper efflux protein ATP7B (WLN4) through a unique sulfur-bridged Mo2S6O2 cluster.
CAS Number
16330-92-0
Target
ATPase
Activity
Transmembrane Transporters
Molecular Formula
MoS4
Storage Conditions
3 years -20°C powder

Chemical Information

Coprexa

Tetrathiomolybdate(2-) is a molybdenum coordination entity. It has a role as a copper chelator.

CAS Number16330-92-0
PubChem CID5245480
IUPAC Namebis(sulfanylidene)molybdenum;sulfanide
Molecular FormulaH2MoS4-2
Molecular Weight226.2
Topological Polar Surface Area66.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count5
Formal Charge-2
Complexity19
SMILES
[SH-].[SH-].S=[Mo]=S
InChI
InChI=1S/Mo.2H2S.2S/h;2*1H2;;/p-2
InChIKey
VVRHUOPINLMZBL-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Coprexa
CAS: 16330-92-0
CID: 5245480
Formula: H2MoS4-2
MW: 226.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight226.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass227.809338
Monoisotopic Mass227.809338
Topological Polar Surface Area66.2 Ų
Heavy Atom Count5
Formal Charge-2
Complexity19.1
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