General Information of the Compound
| Compound ID |
CP0396845
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| Compound Name |
prop-2-enyl N-[4-(8-formyl-7-hydroxy-2-oxochromen-4-yl)butyl]carbamate
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| Structure |
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| Formula |
C18H19NO6
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| Molecular Weight |
345.351
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| Canonical SMILES |
Oc1ccc2c(CCCCNC(=O)OCC=C)cc(=O)oc2c1C=O
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| InChI |
InChI=1S/C18H19NO6/c1-2-9-24-18(23)19-8-4-3-5-12-10-16(22)25-17-13(12)6-7-15(21)14(17)11-20/h2,6-7,10-11,21H,1,3-5,8-9H2,(H,19,23)
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| InChIKey |
KTWUJSNNFLXRRL-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