General Information of the Compound
| Compound ID |
CP0169287
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| Compound Name |
(E)-1,5-bis(4-hydroxy-3-methoxyphenyl)pent-4-ene-1,3-dione
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| Structure |
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| Formula |
C19H18O6
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| Molecular Weight |
342.347
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| Canonical SMILES |
COc1cc(\C=C\C(=O)CC(=O)c2ccc(O)c(OC)c2)ccc1O
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| InChI |
InChI=1S/C19H18O6/c1-24-18-9-12(4-7-15(18)21)3-6-14(20)11-17(23)13-5-8-16(22)19(10-13)25-2/h3-10,21-22H,11H2,1-2H3/b6-3+
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| InChIKey |
WGRFGQJWSXSKER-ZZXKWVIFSA-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