Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B41KYB
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| Binder Name |
2-[(1S,9R,18R,19S,21R,22R,23R,25R,32S,34R,35R,36S)-31-(2-Acetyloxyethyl)-24-phenyl-10,26-dioxa-8,24-diaza-15,31-diazoniaundecacyclo[29.5.2.01,32.02,7.08,36.09,22.013,21.015,19.018,23.025,35.029,34]octatriaconta-2,4,6,12,28-pentaen-15-yl]ethyl acetate;dibromide
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| Synonyms |
CHEMBL395960
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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 |
C46H56Br2N4O6
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| Canonical SMILES |
CC(=O)OCC[N+]12CC[C@H]3[C@@H]1C[C@@H]4[C@@H]5[C@@H]3N([C@H]6[C@@H]7[C@H]8C[C@H]9[C@@]1([C@H]7N([C@@H]5OCC=C4C2)C2=CC=CC=C21)CC[N+]9(CC8=CCO6)CCOC(=O)C)C1=CC=CC=C1.[Br-].[Br-]
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| InChI |
1S/C46H56N4O6.2BrH/c1-28(51)53-22-18-49-16-12-33-38(49)24-34-30(26-49)13-20-55-44-40(34)42(33)47(32-8-4-3-5-9-32)45-41-35-25-39-46(36-10-6-7-11-37(36)48(44)43(41)46)15-17-50(39,19-23-54-29(2)52)27-31(35)14-21-56-45;;/h3-11,13-14,33-35,38-45H,12,15-27H2,1-2H3;2*1H/q+2;;/p-2/t33-,34-,35-,38-,39-,40+,41+,42+,43-,44+,45+,46+,49?,50?;;/m0../s1
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| InChIKey |
UKZPDTRKIBHQLP-JKBBQUHLSA-L
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| PubChem Compound ID | ||||
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