Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BRBH81
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| Binder Name |
4-(2-Carboxy-6-hydroxy-benzoyl)-3,5-dihydroxy-benzoic acid (3S,4S)-3-(4-hydroxy-benzoylamino)-azepan-4-yl ester
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| Synonyms |
CHEMBL77970; (+)-Balanol; BDBM50055671
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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 |
C28H26N2O10
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| Canonical SMILES |
C1C[C@@H]([C@H](CNC1)NC(=O)C2=CC=C(C=C2)O)OC(=O)C3=CC(=C(C(=C3)O)C(=O)C4=C(C=CC=C4O)C(=O)O)O
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| InChI |
1S/C28H26N2O10/c31-16-8-6-14(7-9-16)26(36)30-18-13-29-10-2-5-22(18)40-28(39)15-11-20(33)24(21(34)12-15)25(35)23-17(27(37)38)3-1-4-19(23)32/h1,3-4,6-9,11-12,18,22,29,31-34H,2,5,10,13H2,(H,30,36)(H,37,38)/t18-,22-/m0/s1
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| InChIKey |
XYUFCXJZFZPEJD-AVRDEDQJSA-N
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| PubChem Compound ID | ||||
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