General Information of the Compound
| Compound ID |
CP0374657
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| Compound Name |
1,3,8-Trihydroxy-6-methyl-4,5-bis-(3-methyl-but-2-enyl)-10H-anthracen-9-one
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| Structure |
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| Formula |
C25H28O4
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| Molecular Weight |
392.495
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| Canonical SMILES |
CC(C)=CCc1c(C)cc(O)c2C(=O)c3c(O)cc(O)c(CC=C(C)C)c3Cc12
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| InChI |
InChI=1S/C25H28O4/c1-13(2)6-8-16-15(5)10-21(27)23-18(16)11-19-17(9-7-14(3)4)20(26)12-22(28)24(19)25(23)29/h6-7,10,12,26-28H,8-9,11H2,1-5H3
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| InChIKey |
ZPYUAFAJLDPLNQ-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