Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BPQ64Y
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| Binder Name |
(1R,4S,5S,9R,29R,33S,34S,37R,38R,41S,42R,55R,56S,59R)-5,9,14,14,24,24,29,33,41,56-Decamethyl-11,27,43,54-tetraoxa-14,24-diazonianonacyclo[53.4.1.11,56.137,41.137,42.04,9.05,59.029,34.033,38]trihexacontane-10,28,44,53-tetrone;dibromide
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| Synonyms |
CHEMBL3220805
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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 |
C67H114Br2N2O8
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| Canonical SMILES |
C[C@]12CC[C@H]3[C@@]4(CCC[C@@]5([C@H]4CC[C@@]3(C1)C[C@H]2OC(=O)CCCCCCCCC(=O)O[C@@H]6C[C@]78CC[C@H]9[C@]([C@@H]7CC[C@]6(C8)C)(CCC[C@]9(C(=O)OCC[N+](CCCCCCCCC[N+](CCOC5=O)(C)C)(C)C)C)C)C)C.[Br-].[Br-]
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| InChI |
1S/C67H114N2O8.2BrH/c1-60-36-28-52-62(3)32-24-34-64(5)50(62)30-38-66(52,48-60)46-54(60)76-56(70)26-20-16-12-13-17-21-27-57(71)77-55-47-67-39-31-51-63(4,53(67)29-37-61(55,2)49-67)33-25-35-65(51,6)59(73)75-45-43-69(9,10)41-23-19-15-11-14-18-22-40-68(7,8)42-44-74-58(64)72;;/h50-55H,11-49H2,1-10H3;2*1H/q+2;;/p-2/t50-,51-,52-,53-,54+,55+,60-,61-,62+,63+,64+,65+,66-,67-;;/m0../s1
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| InChIKey |
ILDRHWHGJXOCRT-SPTSPLRXSA-L
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| PubChem Compound ID | ||||
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