General Information of the Compound
| Compound ID |
CP0432895
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| Compound Name |
(2R,3R,4R,5S)-2-[(1R)-1,2-dihydroxyethyl]-5-[4-methyl-3-[(4-propan-2-ylphenyl)methyl]phenyl]oxolane-3,4-diol
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| Structure |
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| Formula |
C23H30O5
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| Molecular Weight |
386.488
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| Canonical SMILES |
CC(C)c1ccc(Cc2cc(ccc2C)[C@@H]2O[C@H]([C@H](O)CO)[C@H](O)[C@H]2O)cc1
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| InChI |
InChI=1S/C23H30O5/c1-13(2)16-8-5-15(6-9-16)10-18-11-17(7-4-14(18)3)22-20(26)21(27)23(28-22)19(25)12-24/h4-9,11,13,19-27H,10,12H2,1-3H3/t19-,20-,21-,22+,23-/m1/s1
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| InChIKey |
OICSLPNJYHCWIL-FWKCKQQBSA-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