General Information of the Compound
| Compound ID |
CP0579363
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| Compound Name |
[(7S)-1,6,6-trimethyl-10,11-dioxo-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-7-yl] acetate
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| Structure |
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| Formula |
C21H20O5
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| Molecular Weight |
352.386
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| Canonical SMILES |
CC(=O)O[C@H]1CCc2c(ccc3-c4occ(C)c4C(=O)C(=O)c23)C1(C)C
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| InChI |
InChI=1S/C21H20O5/c1-10-9-25-20-13-5-7-14-12(17(13)19(24)18(23)16(10)20)6-8-15(21(14,3)4)26-11(2)22/h5,7,9,15H,6,8H2,1-4H3/t15-/m0/s1
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| InChIKey |
ZNETYQNVRDRJJV-HNNXBMFYSA-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