General Information of the Compound
| Compound ID |
CP0502678
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| Compound Name |
1,8-Dihydroxy-10-[2-(3,4,5-trihydroxy-phenyl)-acetyl]-10H-anthracen-9-one
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| Structure |
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| Formula |
C22H16O7
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| Molecular Weight |
392.363
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| Canonical SMILES |
Oc1cccc2C(C(=O)Cc3cc(O)c(O)c(O)c3)c3cccc(O)c3C(=O)c12
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| InChI |
InChI=1S/C22H16O7/c23-13-5-1-3-11-18(12-4-2-6-14(24)20(12)22(29)19(11)13)15(25)7-10-8-16(26)21(28)17(27)9-10/h1-6,8-9,18,23-24,26-28H,7H2
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| InChIKey |
HYUVUMMAOVZCFV-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