Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B3BFE8
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| Binder Name |
[(3As,5aS,6S,7S,9aR,9bR)-6-[(E)-2-[5-(3-fluorophenyl)pyridin-2-yl]ethenyl]-6,9a-dimethyl-1-oxo-3a,4,5,5a,7,8,9,9b-octahydro-3H-benzo[e][2]benzofuran-7-yl] acetate
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| Synonyms |
CHEMBL4074969; BDBM50257981
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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 |
C29H32FNO4
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| Canonical SMILES |
CC(=O)O[C@H]1CC[C@@]2([C@@H]([C@]1(C)/C=C/C3=NC=C(C=C3)C4=CC(=CC=C4)F)CC[C@H]5[C@H]2C(=O)OC5)C
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| InChI |
1S/C29H32FNO4/c1-18(32)35-25-12-14-29(3)24(10-8-21-17-34-27(33)26(21)29)28(25,2)13-11-23-9-7-20(16-31-23)19-5-4-6-22(30)15-19/h4-7,9,11,13,15-16,21,24-26H,8,10,12,14,17H2,1-3H3/b13-11+/t21-,24-,25+,26+,28+,29-/m1/s1
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| InChIKey |
UUIBQQJKIJXJJR-ZUOYKMECSA-N
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| PubChem Compound ID | ||||
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