General Information of the Compound
| Compound ID |
CP0446290
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| Compound Name |
5-methoxy-3-[(4-methoxy-3,5-dimethylphenyl)methyl]-7-pentylchromen-2-one
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| Structure |
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| Formula |
C25H30O4
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| Molecular Weight |
394.511
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| Canonical SMILES |
CCCCCc1cc(OC)c2cc(Cc3cc(C)c(OC)c(C)c3)c(=O)oc2c1
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| InChI |
InChI=1S/C25H30O4/c1-6-7-8-9-18-13-22(27-4)21-15-20(25(26)29-23(21)14-18)12-19-10-16(2)24(28-5)17(3)11-19/h10-11,13-15H,6-9,12H2,1-5H3
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| InChIKey |
ICBAHKSDQHTOGR-UHFFFAOYSA-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