General Information of the Compound
| Compound ID |
CP0518741
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| Compound Name |
hexyl 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyacetate
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| Structure |
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| Formula |
C23H24O6
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| Molecular Weight |
396.439
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| Canonical SMILES |
CCCCCCOC(=O)COc1cc(O)c2c(c1)oc(cc2=O)-c1ccccc1
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| InChI |
InChI=1S/C23H24O6/c1-2-3-4-8-11-27-22(26)15-28-17-12-18(24)23-19(25)14-20(29-21(23)13-17)16-9-6-5-7-10-16/h5-7,9-10,12-14,24H,2-4,8,11,15H2,1H3
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| InChIKey |
ROMGDNPTGDLHKM-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