1-Deazatubercidin
(2R,3R,4S,5R)-2-(4-aminopyrrolo[2,3-b]pyridin-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: 1-Deazatubercidin|KST-1B9047|1-(|A-d-ribofuranosyl)-1h-pyrrolo[2,3-b]pyridin-4-amine|1-Pentofuranosyl-1H-pyrrolo[2,3-b]pyridin-4-amine|4-Amino-1-beta-D-ribofuranosyl-1H-pyrrolo(2,3-b)pyridine|1H-Pyrrolo(2,3-b)pyridin-4-amine, 1-beta-D-ribofuranosyl-|(2R,3R,4S,5R)-2-(4-aminopyrrolo[2,3-b]pyridin-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol|1-beta-D-Ribofuranosyl-1H-pyrrolo[2,3-b]pyridin-4-amine|4-Amino-1-(beta-D-ribofuranosyl)-1H-pyrrolo[2,3-b]pyridine|(2R,3R,4S,5R)-2-{4-amino-1H-pyrrolo[2,3-b]pyridin-1-yl}-5-(hydroxymethyl)oxolane-3,4-diol
| Molecular Formula | C12H15N3O4 |
|---|---|
| Molecular Weight | 265.10626 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.10626 |
| Monoisotopic Mass | 265.10626 |
| Heavy Atoms | 19 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 89283-46-5 |
|---|---|
| SMILES | C1=CN=C2C(=C1N)C=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O |
| InChIKey | ICSYNCVSXUEZDG-DNRKLUKYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Deazatubercidin (CAS 89283-46-5), with molecular formula C12H15N3O4 and molecular weight 265.10626 g/mol. IUPAC: (2R,3R,4S,5R)-2-(4-aminopyrrolo[2,3-b]pyridin-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol.
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