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CAS 161599-46-8 manufacturers and suppliers on PharmaCompass

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CAS 161599-46-8
Also known as: 161599-46-8, 5'-deoxy-2',3'-di-o-acetyl-5-fluorocytidine, Cytidine, 5'-deoxy-5-fluoro-, 2',3'-diacetate, Q6ktk8kqr2, [(2r,3r,4r,5r)-4-acetyloxy-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2-methyloxolan-3-yl] acetate, 2,3-di-o-acetyl-5-deoxy-5-fuluro-d-cytidine
Molecular Formula
C13H16FN3O6
Molecular Weight
329.28  g/mol
InChI Key
NWJBWNIUGNXJGO-RPULLILYSA-N
FDA UNII
Q6KTK8KQR2

1 2D Structure

CAS 161599-46-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[(2R,3R,4R,5R)-4-acetyloxy-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2-methyloxolan-3-yl] acetate
2.1.2 InChI
InChI=1S/C13H16FN3O6/c1-5-9(22-6(2)18)10(23-7(3)19)12(21-5)17-4-8(14)11(15)16-13(17)20/h4-5,9-10,12H,1-3H3,(H2,15,16,20)/t5-,9-,10-,12-/m1/s1
2.1.3 InChI Key
NWJBWNIUGNXJGO-RPULLILYSA-N
2.1.4 Canonical SMILES
CC1C(C(C(O1)N2C=C(C(=NC2=O)N)F)OC(=O)C)OC(=O)C
2.1.5 Isomeric SMILES
C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=C(C(=NC2=O)N)F)OC(=O)C)OC(=O)C
2.2 Other Identifiers
2.2.1 UNII
Q6KTK8KQR2
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 161599-46-8

2. 5'-deoxy-2',3'-di-o-acetyl-5-fluorocytidine

3. Cytidine, 5'-deoxy-5-fluoro-, 2',3'-diacetate

4. Q6ktk8kqr2

5. [(2r,3r,4r,5r)-4-acetyloxy-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2-methyloxolan-3-yl] Acetate

6. 2,3-di-o-acetyl-5-deoxy-5-fuluro-d-cytidine

7. 2', 3'-di-o-acetyl-5'-deoxy-5-fluoro-d-cytidine

8. 2',3'-di-o-acetyl-5'-deoxy-5-fluoro-d-cytidine

9. 1-(2,3-di-o-acetyl-5-deoxy-beta-d-ribofuranosyl)-4-amino-5-fluoropyrimidin-2(1h)-one

10. Unii-q6ktk8kqr2

11. Mfcd07369302

12. C13h16fn3o6

13. 2'',3''-di-o-acetyl-5''-deoxy-5-fuluro-d-cytidine

14. Ec 605-260-4

15. Schembl935809

16. Dtxsid40167207

17. Act05300

18. Zinc19616026

19. Akos015966242

20. Gs-3732

21. 2,3-di-o-acetyl-5-deoxy-5-fluorocytidine

22. 2,3-di-o-acetyl-5-deoxy-5-fulurocytidine

23. 5-deoxy-2,3-di-o-acetyl-5-fluorocytidine

24. Cs-0158243

25. 2',3'-di-o-acetyl-5'-deoxy-5-fluoro-cytidine

26. 599d468

27. A810277

28. W-60381

29. Q63398171

30. (2r,3r,4r,5r)-2-(4-amino-5-fluoro-2-oxopyrimidin-1(2h)-yl)-5-methyl-tetrahydrofuran-3,4-diyl Diacetate

31. (2r,3r,4r,5r)-4-(acetyloxy)-5-(4-amino-5-fluoro-2-oxo-1,2-dihydropyrimidin-1-yl)-2-methyloxolan-3-yl Acetate

2.4 Create Date
2006-10-27
3 Chemical and Physical Properties
Molecular Weight 329.28 g/mol
Molecular Formula C13H16FN3O6
XLogP3-0.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass329.10231340 g/mol
Monoisotopic Mass329.10231340 g/mol
Topological Polar Surface Area121 Ų
Heavy Atom Count23
Formal Charge0
Complexity605
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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161599-46-8
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We are one of the well-known manufacturers of key APIs & intermediates in China, with 20 years of experie...
We are one of the well-known manufacturers of key APIs & intermediates in China, with 20 years of experience & presence in 20+ countries. At Boyuan, we are committed to providing high-quality products & services. Formerly known as “Jinan Boyuan Chemical Co., Ltd” & “Shandong Boyuan Chemical Co., Ltd.” Boyuan was founded in June 2001. We have 2 manufacturing plants in the cities of Jiyang & Yucheng in Shandong Province, China & both are in line with the GMP standard, following a strict quality system & conforming with international standards. Boyuan is dedicated to anti-cancer, anti-fungal & other APIs & intermediates associated.
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Established in 2002, Aurisco is an innovative company dedicated to developing and manufacturing pharmaceu...
Established in 2002, Aurisco is an innovative company dedicated to developing and manufacturing pharmaceutical chemicals serving pharmaceutical companies worldwide. The head office is located in Shanghai. 2 production facilities & 3 R&D centers are separately based in Zhejiang Tiantai & Jiangsu Yangzhou. Aurisco is continually strengthening scientific and technological innovation system,assigning a high priority to advanced R&D as well as state-of the-art plants and equipments to ensure environmental safety -concerned and quality-minded production.
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Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.
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Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.
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Fuan Pharmaceutical (Group) Co., Ltd. was established on February 25, 2004. The company is located in Cho...
Fuan Pharmaceutical (Group) Co., Ltd. was established on February 25, 2004. The company is located in Chongqing Changshou Economic and Technological Development Zone, covering an area of about 100 acres, a construction area of over 30,000 square meters, and a registered capital of 1.189 billion yuan. It is the first company in Changshou Economic and Technological Development Zone successfully listed on the Shenzhen GEM (March 22, 2011, stock code: 300194). The company has 9 wholly-owned and holding subsidiaries. In March 2008, Fuan Pharmaceutical Group Chongqing Lybon Pharm-Tech Co
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Nantong Chem-land Co., Ltd. is located in Nantong city, a developed port city which distance from Shangha...
Nantong Chem-land Co., Ltd. is located in Nantong city, a developed port city which distance from Shanghai is only 1.5 hours by car. Established in 2006, we have developed quickly into a comprehensive entity engaged in and marketing, developing and manufacturing of Active Pharmaceutical Ingredients, intermediates and fine chemicals.Our collaboration production site is in the national chemical park in our city: Nantong Rudong Yangkou Chemical park. Available test instrument in the production site: IR, UV, HPLC, GC, etc.. Production equipment: More than 50 reactors, size from 1L to 3000L , reaction temperature from -10℃ to +300℃.
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OctaneX Labs is a leading intermediates and Active Pharmaceutical Ingredients (API) manufacturing company...
OctaneX Labs is a leading intermediates and Active Pharmaceutical Ingredients (API) manufacturing company specializing in the development of innovative processes for the synthesis of a wide range of products. We also undertake custom pharmaceutical services and contract Research Synthesis. We are commited to create better quality of life by being at the forefront of research, manufacturing and marketing of high quality API'S.As a growing organization, we are aware that we can’t achieve our goals singly. We collaborate and work in unison with a large number of reputed and like-minded partners
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