2'-Deoxyadenosine 5'-O-(2-thiotriphosphate)

Base Information

• Chemical Name: 2'-Deoxyadenosine 5'-O-(2-thiotriphosphate)
• CAS No.: 80227-17-4
• Molecular Formula: C10H16 N5 O11 P3 S
• Molecular Weight: 507.24
• Nikkaji Number: J1.725.018C
• Mol file: 80227-17-4.mol

Synonyms:2'-deoxyadenosine 5'-O-(2-thiotriphosphate);dATPbetaS

Chemical Property of 2'-Deoxyadenosine 5'-O-(2-thiotriphosphate)

Chemical Property:

• XLogP3: -2.7
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 8
• Exact Mass: 506.97798851
• Heavy Atom Count: 30
• Complexity: 774

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1C(C(OC1N2C=NC3=C(N=CN=C32)N)COP(=O)(O)OP(=O)(O)OP(=S)(O)O)O
• Isomeric SMILES: C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)N)COP(=O)(O)OP(=O)(O)OP(=S)(O)O)O