General Information of the Compound
| Compound ID |
CP0376542
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| Compound Name |
1,8-Dihydroxy-10-(3,4,5-trihydroxy-benzylidene)-10H-anthracen-9-one
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| Structure |
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| Formula |
C21H14O6
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| Molecular Weight |
362.337
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| Canonical SMILES |
Oc1cc(C=C2c3cccc(O)c3C(=O)c3c(O)cccc23)cc(O)c1O
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| InChI |
InChI=1S/C21H14O6/c22-14-5-1-3-11-13(7-10-8-16(24)20(26)17(25)9-10)12-4-2-6-15(23)19(12)21(27)18(11)14/h1-9,22-26H
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| InChIKey |
MCYXTPNILAVSKG-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