Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BTR39H
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| Binder Name |
[[(2R,3S,4R,5R)-5-[6-Amino-8-(4-methylphenyl)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate
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| Synonyms |
CHEMBL3350588
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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 |
C28H33N7O14P2
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| Canonical SMILES |
CC1=CC=C(C=C1)C2=NC3=C(N=CN=C3N2[C@H]4[C@@H]([C@@H]([C@H](O4)COP(=O)(O)OP(=O)([O-])OC[C@@H]5[C@H]([C@H]([C@@H](O5)[N+]6=CC=CC(=C6)C(=O)N)O)O)O)O)N
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| InChI |
1S/C28H33N7O14P2/c1-13-4-6-14(7-5-13)25-33-18-23(29)31-12-32-26(18)35(25)28-22(39)20(37)17(48-28)11-46-51(43,44)49-50(41,42)45-10-16-19(36)21(38)27(47-16)34-8-2-3-15(9-34)24(30)40/h2-9,12,16-17,19-22,27-28,36-39H,10-11H2,1H3,(H5-,29,30,31,32,40,41,42,43,44)/t16-,17-,19-,20-,21-,22-,27-,28-/m1/s1
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| InChIKey |
LFKLACYLSOMJIN-VGTXMLLDSA-N
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| PubChem Compound ID | ||||
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