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Adenosine, 2-(ethylsulfonyl)-, 2',3',5'-triacetate

Base Information
  • Chemical Name:Adenosine, 2-(ethylsulfonyl)-, 2',3',5'-triacetate
  • CAS No.:173987-27-4
  • Molecular Formula:C18H23N5O9S
  • Molecular Weight:485.475
  • Hs Code.:
  • DSSTox Substance ID:DTXSID801229560
Adenosine, 2-(ethylsulfonyl)-, 2',3',5'-triacetate

Synonyms:DTXSID801229560;Adenosine, 2-(ethylsulfonyl)-, 2',3',5'-triacetate;173987-27-4

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Chemical Property of Adenosine, 2-(ethylsulfonyl)-, 2',3',5'-triacetate
Chemical Property:
  • XLogP3:-0.8
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:13
  • Rotatable Bond Count:10
  • Exact Mass:485.12164850
  • Heavy Atom Count:33
  • Complexity:866
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MSDS Files:
Useful:
  • Canonical SMILES:CCS(=O)(=O)C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)N
  • Isomeric SMILES:CCS(=O)(=O)C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COC(=O)C)OC(=O)C)OC(=O)C)N
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