General Information of the Compound
| Compound ID |
CP0871177
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| Compound Name |
3-(2-methyl but-3-en-2-yl)xanthyletin
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| Structure |
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| Formula |
C19H20O3
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| Molecular Weight |
296.366
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| Canonical SMILES |
C=CC(C)(C)c1cc2cc3c(cc2oc1=O)OC(C)(C)C=C3
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| InChI |
InChI=1S/C19H20O3/c1-6-18(2,3)14-10-13-9-12-7-8-19(4,5)22-16(12)11-15(13)21-17(14)20/h6-11H,1H2,2-5H3
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| InChIKey |
DWYNSYAYGXNRPD-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