General Information of the Compound
| Compound ID |
CP0562177
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| Compound Name |
2-(3,4-Dihydroxy-phenyl)-6-hexadecyloxy-5-hydroxy-7-methoxy-chromen-4-one
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| Structure |
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| Formula |
C32H44O7
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| Molecular Weight |
540.697
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| Canonical SMILES |
CCCCCCCCCCCCCCCCOc1c(OC)cc2oc(cc(=O)c2c1O)-c1ccc(O)c(O)c1
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| InChI |
InChI=1S/C32H44O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-38-32-29(37-2)22-28-30(31(32)36)26(35)21-27(39-28)23-17-18-24(33)25(34)20-23/h17-18,20-22,33-34,36H,3-16,19H2,1-2H3
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| InChIKey |
MNLYMKCSPADTAF-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