General Information of the Compound
| Compound ID |
CP0552735
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| Compound Name |
prop-2-enyl 6-formyl-5-hydroxy-9-oxo-8-oxa-12-azatricyclo[8.6.0.02,7]hexadeca-1(10),2(7),3,5-tetraene-12-carboxylate
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| Structure |
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| Formula |
C19H19NO6
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| Molecular Weight |
357.362
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| Canonical SMILES |
Oc1ccc2c3CCCCN(Cc3c(=O)oc2c1C=O)C(=O)OCC=C
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| InChI |
InChI=1S/C19H19NO6/c1-2-9-25-19(24)20-8-4-3-5-12-13-6-7-16(22)15(11-21)17(13)26-18(23)14(12)10-20/h2,6-7,11,22H,1,3-5,8-10H2
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| InChIKey |
QLXJRUHYMGPSSJ-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