General Information of the Compound
| Compound ID |
CP0430168
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| Compound Name |
(2S,3R,4R,5S)-2-(3-(4-Ethoxybenzyl)phenyl)-6-methoxytetrahydro-2H-pyran-3,4,5-triol
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| Structure |
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| Formula |
C21H26O6
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| Molecular Weight |
374.433
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| Canonical SMILES |
CCOc1ccc(Cc2cccc(c2)[C@@H]2OC(OC)[C@@H](O)[C@H](O)[C@H]2O)cc1
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| InChI |
InChI=1S/C21H26O6/c1-3-26-16-9-7-13(8-10-16)11-14-5-4-6-15(12-14)20-18(23)17(22)19(24)21(25-2)27-20/h4-10,12,17-24H,3,11H2,1-2H3/t17-,18-,19+,20+,21?/m1/s1
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| InChIKey |
HUUIJUQVHFPDNW-AUGMSIGLSA-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