Molybdate(2-), (mono(((5aR,8R,9aR)-2-amino-3,5,8,10-tetrahydro-6,7-bis(mercapto-kappaS)-4-oxo-4H-pyrano(3,2-g)pteridin-8-yl)methyl) phosphato(4-))dioxo-, hydrogen (1:2), (T-4)-

Base Information

• Chemical Name: Molybdate(2-), (mono(((5aR,8R,9aR)-2-amino-3,5,8,10-tetrahydro-6,7-bis(mercapto-kappaS)-4-oxo-4H-pyrano(3,2-g)pteridin-8-yl)methyl) phosphato(4-))dioxo-, hydrogen (1:2), (T-4)-
• CAS No.: 73508-07-3
• Molecular Formula: C10H14N5O6PS2
• Molecular Weight: 525.32700
• UNII: ATN6EG42UQ
• Wikipedia: Molybdenum_cofactor
• Mol file: 73508-07-3.mol

Synonyms:Moco cofactor;molybdenum cofactor;molybdopterin;molybdopterin cofactor;pterin molybdenum cofactor

Chemical Property of Molybdate(2-), (mono(((5aR,8R,9aR)-2-amino-3,5,8,10-tetrahydro-6,7-bis(mercapto-kappaS)-4-oxo-4H-pyrano(3,2-g)pteridin-8-yl)methyl) phosphato(4-))dioxo-, hydrogen (1:2), (T-4)-

Chemical Property:

• Vapor Pressure: 4.44E-22mmHg at 25°C
• Boiling Point: 710.3°C at 760 mmHg
• Flash Point: 383.4°C
• PSA: 284.34000
• Density: 2.41g/cm³
• LogP: 0.82970
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 2
• Exact Mass: 522.891895
• Heavy Atom Count: 27
• Complexity: 740

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [H+].[H+].C(C1C(=C(C2C(O1)NC3=C(N2)C(=O)NC(=N3)N)[S-])[S-])OP(=O)([O-])[O-].O=[Mo+2]=O
• Isomeric SMILES: [H+].[H+].C([C@@H]1C(=C([C@H]2[C@@H](O1)NC3=C(N2)C(=O)NC(=N3)N)[S-])[S-])OP(=O)([O-])[O-].O=[Mo+2]=O