Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BRE4P2
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| Binder Name |
(1E,4S,4Ar,5R,6aS,7S,9aR)-5-(acetyloxy)-1-[[[3-(dimethylamino)propyl]methylamino]methylene]-4a,5,6,6a,7,8,9,9a-octahydro-cyclopenta[5,6]naphtho[1,2-c]pyran-2,10(1H,4H)-dione
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| Synonyms |
CHEMBL410643; ZINC29134475; WAY-266176
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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 |
C29H42N2O8
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| Canonical SMILES |
CC(=O)O[C@@H]1C[C@]2([C@@H](CC[C@@H]2O)C3=C1[C@]4([C@H](OC(=O)/C(=C/N(C)CCCN(C)C)/C4=C(C3=O)O)COC)C)C
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| InChI |
1S/C29H42N2O8/c1-16(32)38-19-13-28(2)18(9-10-20(28)33)22-24(19)29(3)21(15-37-7)39-27(36)17(23(29)26(35)25(22)34)14-31(6)12-8-11-30(4)5/h14,18-21,33,35H,8-13,15H2,1-7H3/b17-14+/t18-,19+,20-,21+,28-,29-/m0/s1
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| InChIKey |
YDFKITVDFUHUQY-DATHZOKXSA-N
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| PubChem Compound ID | ||||
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