Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B47AQS
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| Binder Name |
7-[3-[[(5S,5As,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]amino]phenoxy]-N-(2-aminophenyl)heptanamide
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| Synonyms |
CHEMBL2442695
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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 |
C40H43N3O9
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| Canonical SMILES |
COC1=CC(=CC(=C1O)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@@H](C4=CC5=C(C=C24)OCO5)NC6=CC(=CC=C6)OCCCCCCC(=O)NC7=CC=CC=C7N
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| InChI |
1S/C40H43N3O9/c1-47-33-16-23(17-34(48-2)39(33)45)36-26-19-31-32(52-22-51-31)20-27(26)38(28-21-50-40(46)37(28)36)42-24-10-9-11-25(18-24)49-15-8-4-3-5-14-35(44)43-30-13-7-6-12-29(30)41/h6-7,9-13,16-20,28,36-38,42,45H,3-5,8,14-15,21-22,41H2,1-2H3,(H,43,44)/t28-,36+,37-,38+/m0/s1
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| InChIKey |
SRZNSMLZCZSGHQ-GHCWVHGPSA-N
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| PubChem Compound ID | ||||
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