General Information of the Compound
| Compound ID |
CP0365175
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| Compound Name |
1-[5-[1-(7-acetyl-4,6-dihydroxy-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl)-3-methylbutyl]-4,6-dihydroxy-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-7-yl]ethanone
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| Structure |
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| Formula |
C31H36O8
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| Molecular Weight |
536.621
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| Canonical SMILES |
CC(C)CC(c1c(O)c2CC(Oc2c(C(C)=O)c1O)C(C)=C)c1c(O)c2CC(Oc2c(C(C)=O)c1O)C(C)=C
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| InChI |
InChI=1S/C31H36O8/c1-12(2)9-17(24-26(34)18-10-20(13(3)4)38-30(18)22(15(7)32)28(24)36)25-27(35)19-11-21(14(5)6)39-31(19)23(16(8)33)29(25)37/h12,17,20-21,34-37H,3,5,9-11H2,1-2,4,6-8H3
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| InChIKey |
FAOJHQIMOPCHII-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