General Information of the Compound
| Compound ID |
CP0076250
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| Compound Name |
(1S)-1,5-Anhydro-1-[5-(4-ethoxybenzyl)-2-methoxy-4-methylphenyl]-1-thio-D-glucitol
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| Synonyms |
(1S)-1,5-Anhydro-1-[5-(4-ethoxybenzyl)-2-methoxy-4-methylphenyl]-1-thio-D-glucitol
898537-18-3
AKOS027326750
BDBM50315426
C596HWF74Z
CHEBI:134725
CHEMBL1093423
D-Glucitol, 1,5-dideoxy-1,5-epithio-1-C-(5-((4-ethoxyphenyl)methyl)-2-methoxy-4-methylphenyl)-, (1S)-
D-Glucitol, 1,5-dideoxy-1,5-epithio-1-C-[5-[(4-ethoxyphenyl)methyl]-2-methoxy-4-methylphenyl]-, (1S)
DB12214
DTXSID10237921
Luseogliflozin
Luseogliflozin [INN]
SB11169
SCHEMBL1487519
TS 071
TS-071
TS-71
Tube105
UNII-C596HWF74Z
ZINC49087932
ts71
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| Structure |
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| Formula |
C23H30O6S
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| Molecular Weight |
434.554
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| Canonical SMILES |
CCOc1ccc(Cc2cc([C@@H]3S[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)cc2C)cc1
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| InChI |
InChI=1S/C23H30O6S/c1-4-29-16-7-5-14(6-8-16)10-15-11-17(18(28-3)9-13(15)2)23-22(27)21(26)20(25)19(12-24)30-23/h5-9,11,19-27H,4,10,12H2,1-3H3/t19-,20-,21+,22-,23+/m1/s1
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| InChIKey |
WHSOLWOTCHFFBK-ZQGJOIPISA-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
Clinical Information about the Compound