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Basic information

  • Name:
  • 2H-Oxacyclotetradecino[4,3-d]oxazole-2,6,8,14(1H,7H,9H)-tetrone,4-ethyloctahydro-11-methoxy-3a,7,9,11,13,15-hexamethyl-1-[4-[4-(3-pyridinyl)-1H-imidazol-1-yl]butyl]-10-[[3,4,6-trideoxy-3-(dimethylamino)-b-D-xylo-hexopyranosyl]oxy]-,(3aS,4R,7R,9R,10R,11R,13R,15R,15aR)-

  • Superlist Name:
  • Telithromycin
  • CAS No.:
  • 191114-48-4

  • Formula:
  • C43H65N5O10
  • Synonyms:
  • Erythromycin,3-de[(2,6-dideoxy-3-C-methyl-3-O-methyl-a-L-ribo-hexopyranosyl)oxy]-11,12-dideoxy-6-O-methyl-3-oxo-12,11-[oxycarbonyl[[4-[4-(3-pyridinyl)-1H-imidazol-1-yl]butyl]imino]]-;HMR 3647;Ketek;RU 66647;
Home > Hot Product_List > Telithromycin
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China (Mainland)(19)United States(3)Hong Kong(1)India(1)
Business Type:
Importer/Exporter(18)Lab/Research institutions(1)Manufacturers(1)
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History

French pharmaceutical company Hoechst Marion Roussel (later Sanofi-Aventis) began phase II/III clinical trials of telithromycin (HMR-3647) in 1998. Telithromycin was approved by the European Commission in July 2001 and subsequently went on sale in October 2001. In the US, telithromycin received FDA approval on April 1, 2004 .

Specification

The Telithromycin is an organic compound with the formula C43H65N5O10. The IUPAC name of this chemical is (1R,2S,4R,6R,7R,8R,10S,13S,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-13-ethyl-6-methoxy-2,4,6,8,10,14-hexamethyl-17-[4-(4-pyridin-3-ylimidazol-1-yl)butyl]-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone. With the CAS registry number 191114-48-4, it is also named as 2H-oxacyclotetradecino[4,3-d]oxazole-2,6,8,14(1H,7H,9H)-tetrone, 4-ethyloctahydro-11-methoxy-3a,7,9,11,13,15-hexamethyl-1-[4-[4-(3-pyridinyl)-1H-imidazol-1-yl]butyl]-10-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]-, (3aS,4S,7R,9R,10R,11S,13R,15S,15aR)-. The product's classification codes are Anti-Bacterial Agents; Anti-Infective Agents; Antibacterial; Antimicrobial. Besides, it is the first ketolide antibiotic to enter clinical use. It is used to treat mild to moderate respiratory infections.

Physical properties about Telithromycin are: (1)ACD/LogP: 3.58; (2)# of Rule of 5 Violations: 2; (3)#H bond acceptors: 15; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 12; (6)Polar Surface Area: 160.85 Å2; (7)Index of Refraction: 1.588; (8)Molar Refractivity: 216.19 cm3; (9)Molar Volume: 641.7 cm3; (10)Polarizability: 85.7×10-24cm3; (11)Surface Tension: 44 dyne/cm; (12)Density: 1.26 g/cm3; (13)Flash Point: 538.2 °C; (14)Enthalpy of Vaporization: 147.43 kJ/mol; (15)Boiling Point: 966.2 °C at 760 mmHg.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2[C@@H]([C@@H](O[C@@H]1O[C@@H](C[C@H](N(C)C)[C@H]1O)C)[C@](OC)(C)C[C@H](C(=O)[C@@H](C)[C@H]3N(C(=O)O[C@]3(C)[C@@H](OC(=O)[C@@H]2C)CC)CCCCn4cc(nc4)c5cccnc5)C)C
(2)InChI: InChI=1/C43H65N5O10/c1-12-33-43(8)37(48(41(53)58-43)19-14-13-18-47-23-31(45-24-47)30-16-15-17-44-22-30)27(4)34(49)25(2)21-42(7,54-11)38(28(5)35(50)29(6)39(52)56-33)57-40-36(51)32(46(9)10)20-26(3)55-40/h15-17,22-29,32-33,36-38,40,51H,12-14,18-21H2,1-11H3/t25-,26-,27-,28+,29-,32+,33+,36-,37-,38-,40+,42+,43-/m1/s1
(3)InChIKey: LJVAJPDWBABPEJ-WIFJXVANBD
(4)Std. InChI: InChI=1S/C43H65N5O10/c1-12-33-43(8)37(48(41(53)58-43)19-14-13-18-47-23-31(45-24-47)30-16-15-17-44-22-30)27(4)34(49)25(2)21-42(7,54-11)38(28(5)35(50)29(6)39(52)56-33)57-40-36(51)32(46(9)10)20-26(3)55-40/h15-17,22-29,32-33,36-38,40,51H,12-14,18-21H2,1-11H3/t25-,26-,27-,28+,29-,32+,33+,36-,37-,38-,40+,42+,43-/m1/s1
(5)Std. InChIKey: LJVAJPDWBABPEJ-WIFJXVANSA-N

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