General Information of the Compound
| Compound ID |
CP0448703
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| Compound Name |
Acetic acid 1,8-diacetoxy-9,10-dihydro-anthracen-9-yl ester
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| Structure |
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| Formula |
C20H18O6
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| Molecular Weight |
354.358
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| Canonical SMILES |
CC(=O)OC1c2c(Cc3cccc(OC(C)=O)c13)cccc2OC(C)=O
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| InChI |
InChI=1S/C20H18O6/c1-11(21)24-16-8-4-6-14-10-15-7-5-9-17(25-12(2)22)19(15)20(18(14)16)26-13(3)23/h4-9,20H,10H2,1-3H3
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| InChIKey |
GLQBFFQFXMNLLL-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