General Information of the Compound
| Compound ID |
CP0486320
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| Compound Name |
(9aS)-8-acetyl-N-[(2-ethyl-7-fluoronaphthalen-1-yl)methyl]-1,7-dihydroxy-3-methoxy-9a-methyl-9-oxodibenzofuran-4-carboxamide
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| Structure |
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| Formula |
C30H26FNO7
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| Molecular Weight |
531.536
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| Canonical SMILES |
CCc1ccc2ccc(F)cc2c1CNC(=O)c1c2OC3=CC(O)=C(C(C)=O)C(=O)[C@@]3(C)c2c(O)cc1OC
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| InChI |
InChI=1S/C30H26FNO7/c1-5-15-6-7-16-8-9-17(31)10-18(16)19(15)13-32-29(37)25-22(38-4)11-21(35)26-27(25)39-23-12-20(34)24(14(2)33)28(36)30(23,26)3/h6-12,34-35H,5,13H2,1-4H3,(H,32,37)/t30-/m1/s1
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| InChIKey |
BOMGJYPXXOXOEC-SSEXGKCCSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound