General Information of the Compound
| Compound ID |
CP0424982
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| Compound Name |
(2S,3R,4S,5S,6R)-2-(3-(4-methoxyphenethyl)-1H-indol-4-yloxy)-6-(hydroxymethyl)-tetrahydro-2H-pyran-3,4,5-triol
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| Structure |
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| Formula |
C23H27NO7
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| Molecular Weight |
429.469
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| Canonical SMILES |
COc1ccc(CCc2c[nH]c3cccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c23)cc1
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| InChI |
InChI=1S/C23H27NO7/c1-29-15-9-6-13(7-10-15)5-8-14-11-24-16-3-2-4-17(19(14)16)30-23-22(28)21(27)20(26)18(12-25)31-23/h2-4,6-7,9-11,18,20-28H,5,8,12H2,1H3/t18-,20-,21+,22-,23-/m1/s1
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| InChIKey |
ZETFQCZSERGWIR-DODNOZFWSA-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
Protein ID: PT03804, Sodium/glucose cotransporter 1
Protein ID: PT02415, Sodium/glucose cotransporter 2