Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
B5BI2A
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| Binder Name |
2-[(4-Acetylphenyl)ethynyl]-N6-methoxy-5''-N-methylcarboxamidoadenosine
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| Synonyms |
CHEMBL223625; BDBM50205714
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL |
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| Formula |
C22H22N6O6
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| Canonical SMILES |
CC(=O)C1=CC=C(C=C1)C#CC2=NC(=C3C(=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)C(=O)NC)O)O)NOC
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| InChI |
1S/C22H22N6O6/c1-11(29)13-7-4-12(5-8-13)6-9-14-25-19(27-33-3)15-20(26-14)28(10-24-15)22-17(31)16(30)18(34-22)21(32)23-2/h4-5,7-8,10,16-18,22,30-31H,1-3H3,(H,23,32)(H,25,26,27)/t16-,17+,18-,22+/m0/s1
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| InChIKey |
VGHWQWQBYNQEDX-RQXXJAGISA-N
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| PubChem Compound ID | ||||
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