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97224-58-3

97224-58-3 Structure

97224-58-3 Structure
IdentificationBack Directory
[Name]

7-DEAZA-2'-DEOXYINOSINE
[CAS]

97224-58-3
[Synonyms]

7-Deaza-2'-dI
7-Deazadeoxyinosine
7-DEAZA-2'-DEOXYINOSINE
2'-Deoxy-7-deazainosine
7-(2-deoxy-β-D-erythro-pentofuranosyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
[Molecular Formula]

C11H13N3O4
[MDL Number]

MFCD07778652
[MOL File]

97224-58-3.mol
[Molecular Weight]

251.24
Chemical PropertiesBack Directory
[Melting point ]

235-236 °C (decomp)(Solv: water (7732-18-5))
[Boiling point ]

630.5±55.0 °C(Predicted)
[density ]

1.75±0.1 g/cm3(Predicted)
[pka]

12.45±0.20(Predicted)
[InChI]

InChI=1/C11H13N3O4/c15-4-8-7(16)3-9(18-8)14-2-1-6-10(14)12-5-13-11(6)17/h1-2,5,7-9,15-16H,3-4H2,(H,12,13,17)/t7-,8+,9+/s3
[InChIKey]

DLWAVFIOUHJFFQ-AGECWMLJNA-N
[SMILES]

O=C1N=CNC2=C1C=CN2[C@H]1C[C@@H]([C@H](O1)CO)O |&1:10,12,13,r|
Hazard InformationBack Directory
[Uses]

7-Deaza-2''-deoxyinosine is a nucleoside showing ambiguous base-?pairing properties against the four canonical DNA constituents.
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