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| Standard English name | |
|---|---|
| Cas No. | 151707-53-8 |
| Alias | (2R,3R,4R,5R)-2-(4-amino-6-bromo-5-cyano-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-((benzoyloxy)methyl)tetrahydrofuran-3,4-diyl dibenzoate |
| Canonical Smiles | NC1N=CN=C2C=1C(C#N)=C(Br)N2[C@@H]1O[C@H](COC(=O)C2C=CC=CC=2)[C@@H](OC(=O)C2C=CC=CC=2)[C@H]1OC(=O)C1C=CC=CC=1 |
| MDL No. | MFCD30718451 |
| Exact Mass | 681.08591 |
| Smiles | O=C(OC[C@@H]1[C@@H](OC(C2=CC=CC=C2)=O)[C@@H](OC(C3=CC=CC=C3)=O)[C@H](N4C(Br)=C(C#N)C5=C(N)N=CN=C54)O1)C6=CC=CC=C6 |
| Character | |
|---|---|
| Storage Condition | |
| Melting Point | |
| Boiling Point | 859.5±65.0 °C(Predicted) |
| Flash Point | |
| Chemical Stability | |
| Density | 1.56±0.1 g/cm3(Predicted) |
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| Feature | |
| Useage | |
| Inchi | InChI=1S/C33H24BrN5O7/c34-27-22(16-35)24-28(36)37-18-38-29(24)39(27)30-26(46-33(42)21-14-8-3-9-15-21)25(45-32(41)20-12-6-2-7-13-20)23(44-30)17-43-31(40)19-10-4-1-5-11-19/h1-15,18,23,25-26,30H,17H2,(H2,36,37,38)/t23-,25-,26-,30-/m1/s1 |
| InchiKey | ZAWGKZQDLITTKU-NYBSAPDNSA-N |
| Remark |
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