General Information of the Compound
| Compound ID |
CP0532094
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| Compound Name |
[2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-6-yl] 3,5-dihydroxybenzoate
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| Structure |
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| Formula |
C18H18O6
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| Molecular Weight |
330.336
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| Canonical SMILES |
CC(C)(O)C1Cc2ccc(OC(=O)c3cc(O)cc(O)c3)cc2O1
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| InChI |
InChI=1S/C18H18O6/c1-18(2,22)16-7-10-3-4-14(9-15(10)24-16)23-17(21)11-5-12(19)8-13(20)6-11/h3-6,8-9,16,19-20,22H,7H2,1-2H3
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| InChIKey |
GHTFYAHUUUVRHG-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