General Information of the Compound
| Compound ID |
CP0442596
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| Compound Name |
3-(3,4-Dihydroxy-phenyl)-1-(2-hydroxy-5-methoxy-phenyl)-propenone
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| Structure |
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| Formula |
C16H14O5
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| Molecular Weight |
286.283
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| Canonical SMILES |
COc1ccc(O)c(c1)C(=O)\C=C\c1ccc(O)c(O)c1
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| InChI |
InChI=1S/C16H14O5/c1-21-11-4-7-14(18)12(9-11)13(17)5-2-10-3-6-15(19)16(20)8-10/h2-9,18-20H,1H3/b5-2+
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| InChIKey |
KDGMLUXIGGDXHG-GORDUTHDSA-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