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Chemistry

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Also known as: 898537-18-3, Luseogliflozin [inn], Ts-071, Ts-71, C596hwf74z, Chembl1093423
Molecular Formula
C23H30O6S
Molecular Weight
434.5  g/mol
InChI Key
WHSOLWOTCHFFBK-ZQGJOIPISA-N
FDA UNII
C596HWF74Z

Luseogliflozin
Luseogliflozin has been used in trials studying the treatment of Diabetes Melltius, Type 2.
1 2D Structure

Luseogliflozin

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S,3R,4R,5S,6R)-2-[5-[(4-ethoxyphenyl)methyl]-2-methoxy-4-methylphenyl]-6-(hydroxymethyl)thiane-3,4,5-triol
2.1.2 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
2.1.3 InChI Key
WHSOLWOTCHFFBK-ZQGJOIPISA-N
2.1.4 Canonical SMILES
CCOC1=CC=C(C=C1)CC2=CC(=C(C=C2C)OC)C3C(C(C(C(S3)CO)O)O)O
2.1.5 Isomeric SMILES
CCOC1=CC=C(C=C1)CC2=CC(=C(C=C2C)OC)[C@H]3[C@@H]([C@H]([C@@H]([C@H](S3)CO)O)O)O
2.2 Other Identifiers
2.2.1 UNII
C596HWF74Z
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 1,5-anhydro-1-(5-(4-ethoxybenzyl)-2-methoxy-4-methylphenyl)-1-thioglucitol

2. Lusefi

3. Ts 071

4. Ts-071

5. Ts071 Cpd

2.3.2 Depositor-Supplied Synonyms

1. 898537-18-3

2. Luseogliflozin [inn]

3. Ts-071

4. Ts-71

5. C596hwf74z

6. Chembl1093423

7. Lusefi

8. (2s,3r,4r,5s,6r)-2-(5-(4-ethoxybenzyl)-2-methoxy-4-methylphenyl)-6-(hydroxymethyl)tetrahydro-2h-thiopyran-3,4,5-triol

9. (2s,3r,4r,5s,6r)-2-[5-[(4-ethoxyphenyl)methyl]-2-methoxy-4-methylphenyl]-6-(hydroxymethyl)thiane-3,4,5-triol

10. D-glucitol, 1,5-dideoxy-1,5-epithio-1-c-(5-((4-ethoxyphenyl)methyl)-2-methoxy-4-methylphenyl)-, (1s)-

11. D-glucitol, 1,5-dideoxy-1,5-epithio-1-c-[5-[(4-ethoxyphenyl)methyl]-2-methoxy-4-methylphenyl]-, (1s)-

12. Ts 071

13. Unii-c596hwf74z

14. (2s,3r,4r,5s,6r)-2-(5-((4-ethoxyphenyl)methyl)-2-methoxy-4-methylphenyl)-6-(hydroxymethyl)thiane-3,4,5-triol

15. Ts71

16. Ts071 Cpd

17. Luseogliflozin [mi]

18. Schembl1487519

19. Luseogliflozin [who-dd]

20. Dtxsid10237921

21. Chebi:134725

22. Ts071

23. Bdbm50315426

24. Akos027326750

25. Db12214

26. D-glucitol, 1,5-dideoxy-1,5-epithio-1-c-[5-[(4-ethoxyphenyl)methyl]-2-methoxy-4-methylphenyl]-, (1s)

27. A13476

28. Q27275212

29. (1s)-1,5-anhydro-1-[5-(4-ethoxybenzyl)-2-methoxy-4-methylphenyl]-1-thio-d-glucitol

2.4 Create Date
2007-02-05
3 Chemical and Physical Properties
Molecular Weight 434.5 g/mol
Molecular Formula C23H30O6S
XLogP32.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area125
Heavy Atom Count30
Formal Charge0
Complexity514
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 ATC Code

A - Alimentary tract and metabolism

A10 - Drugs used in diabetes

A10B - Blood glucose lowering drugs, excl. insulins

A10BK - Sodium-glucose co-transporter 2 (sglt2) inhibitors

A10BK07 - Luseogliflozin


API SUPPLIERS

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Metrochem API Private Limited

India

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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AES 2024
Not Confirmed
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Virtual BoothMetrochem has been delivering customized volume & quality products to customers across the world, taking utmost care of their needs.

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Metrochem

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J&H CHEM

China

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

AES 2024
Not Confirmed
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J&H CHEM

China

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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AES 2024
Not Confirmed
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Ningbo Inno Pharmchem

China

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

AES 2024
Not Confirmed
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