Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B3NX8L
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| Binder Name |
(4As,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[3-[[(2R,4S)-1-ethoxycarbonyl-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-4-yl]amino]-3-oxopropanoyl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
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| Synonyms |
CHEMBL4068513; BDBM50234591
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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 |
C48H67F3N2O7
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| Canonical SMILES |
CC[C@@H]1C[C@@H](C2=C(N1C(=O)OCC)C=CC(=C2)C(F)(F)F)NC(=O)CC(=O)O[C@H]3CC[C@]4([C@H](C3(C)C)CC[C@@]5([C@@H]4CC=C6[C@]5(CC[C@@]7([C@H]6CC(CC7)(C)C)C(=O)O)C)C)C
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| InChI |
1S/C48H67F3N2O7/c1-10-29-25-33(30-24-28(48(49,50)51)12-14-34(30)53(29)41(58)59-11-2)52-38(54)26-39(55)60-37-17-18-44(7)35(43(37,5)6)16-19-46(9)36(44)15-13-31-32-27-42(3,4)20-22-47(32,40(56)57)23-21-45(31,46)8/h12-14,24,29,32-33,35-37H,10-11,15-23,25-27H2,1-9H3,(H,52,54)(H,56,57)/t29-,32+,33+,35+,36-,37+,44+,45-,46-,47+/m1/s1
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| InChIKey |
LNPKWOZQGCIJMT-JLJRNCQMSA-N
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| PubChem Compound ID | ||||
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