General Information of the Compound
| Compound ID |
CP0373904
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| Compound Name |
5,6,7-trimethoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one
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| Structure |
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| Formula |
C21H22O8
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| Molecular Weight |
402.399
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| Canonical SMILES |
COc1cc(cc(OC)c1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)cc2o1
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| InChI |
InChI=1S/C21H22O8/c1-23-15-7-11(8-16(24-2)19(15)26-4)13-9-12(22)18-14(29-13)10-17(25-3)20(27-5)21(18)28-6/h7-10H,1-6H3
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| InChIKey |
DYDFNKUHYXHWFM-UHFFFAOYSA-N
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| CAS |
29043-07-0
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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