General Information of the Compound
| Compound ID |
CP0262974
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| Compound Name |
(E)-3-(3,4-Dihydroxy-phenyl)-acrylic acid ethyl ester
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| Structure |
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| Formula |
C11H12O4
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| Molecular Weight |
208.213
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| Canonical SMILES |
CCOC(=O)\C=C\c1ccc(O)c(O)c1
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| InChI |
InChI=1S/C11H12O4/c1-2-15-11(14)6-4-8-3-5-9(12)10(13)7-8/h3-7,12-13H,2H2,1H3/b6-4+
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| InChIKey |
WDKYDMULARNCIS-GQCTYLIASA-N
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| CAS |
66648-50-8
102-37-4
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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