| Identification | Back Directory | [Name]
1-deazaadenosine | [CAS]
14432-09-8 | [Synonyms]
1-deazaadenosine
Deazaadenosine, 1-
3-β-D-Ribofuranosyl-3H-imidazo[4,5-b]pyridin-7-amine
3H-Imidazo[4,5-b]pyridin-7-amine, 3-β-D-ribofuranosyl-
3H-IMidazo[4,5-b]pyridin-7-aMine, 3-b-D-ribofuranosyl-
3-beta-D-Ribofuranosyl-3H-imidazo[4,5-b]pyridin-7-amine
7-Amino-3-(β-D-ribofuranosyl)-3H-imidazo[4,5-b]pyridine | [Molecular Formula]
C11H14N4O4 | [MDL Number]
MFCD22683837 | [MOL File]
14432-09-8.mol | [Molecular Weight]
266.253 |
| Chemical Properties | Back Directory | [Melting point ]
263-264 °C (decomp)(Solv: water (7732-18-5)) | [Boiling point ]
674.6±65.0 °C(Predicted) | [density ]
1.90±0.1 g/cm3(Predicted) | [storage temp. ]
Store at -20°C | [solubility ]
Soluble to 25 mM in DMSO | [form ]
Powder | [pka]
13.21±0.70(Predicted) | [color ]
White to off-white | [InChI]
InChI=1/C11H14N4O4/c12-5-1-2-13-10-7(5)14-4-15(10)11-9(18)8(17)6(3-16)19-11/h1-2,4,6,8-9,11,16-18H,3H2,(H2,12,13)/t6-,8-,9-,11-/s3 | [InChIKey]
NVUDDRWKCUAERS-SOMIAQKHNA-N | [SMILES]
C12N([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C=NC1=C(N)C=CN=2 |&1:2,4,7,9,r| |
| Hazard Information | Back Directory | [Uses]
1-Deazaadenosine is a potent Adenosine deaminase (ADA) inhibitor with a Ki value of 0.66 μM. 1-Deazaadenosine exhibits anti-cancer activities in vitro and has the potential to be a chemotherapy agent for lymphoproliferative disorders[1][2]. | [storage]
Store at +4°C | [References]
[1] Cristalli G, et al.Adenosine deaminase inhibitors: Structure-activity relationships in 1-deazaadenosine and erythro-9-(2-hydroxy-3-nonyl)adenine analogues. Drug Dev.Res.
[2] Cristalli G, et al.Improved synthesis and antitumor activity of 1-deazaadenosine.J Med Chem. 1987 Sep;30(9):1686-8. DOI:10.1021/jm00392a029 |
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