(9S)-9-[[(4-Chlorophenyl)Sulfonyl]Amino]-9-Deoxoerythromycin
[CAS# 56998-45-9]

Identification

• Name: (9S)-9-[[(4-Chlorophenyl)Sulfonyl]Amino]-9-Deoxoerythromycin
• Synonyms: 4-Chloro-N-[10-(4-Dimethylamino-3-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-2-Ethyl-3,4,9-Trihydroxy-12-(5-Hydroxy-4-Methoxy-4,6-Dimethyl-Tetrahydropyran-2-Yl)Oxy-3,5,7,9,11,13-Hexamethyl-14-Oxo-1-Oxacyclotetradec-6-Yl]Benzenesulfonamide; 4-Chloro-N-[10-[(4-Dimethylamino-3-Hydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-2-Ethyl-3,4,9-Trihydroxy-12-[(5-Hydroxy-4-Methoxy-4,6-Dimethyl-2-Tetrahydropyranyl)Oxy]-3,5,7,9,11,13-Hexamethyl-14-Oxo-1-Oxacyclotetradec-6-Yl]Benzenesulfonamide; 4-Chloro-N-[10-(4-Dimethylamino-3-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-2-Ethyl-3,4,9-Trihydroxy-12-(5-Hydroxy-4-Methoxy-4,6-Dimethyl-Tetrahydropyran-2-Yl)Oxy-14-Keto-3,5,7,9,11,13-Hexamethyl-1-Oxacyclotetradec-6-Yl]Benzenesulfonamide
• Molecular Formula: C₄₃H₇₃ClN₂O₁₄S
• Molecular Weight: 909.57
• CAS Registry Number: 56998-45-9
• SMILES: C4=C([S](=O)(=O)NC3C(C(O)C(O)(C(OC(=O)C(C(OC1OC(C(O)C(OC)(C1)C)C)C(C(OC2OC(CC(N(C)C)C2O)C)C(O)(CC3C)C)C)C)CC)C)C)C=CC(=C4)Cl
• InChI: 1S/C43H73ClN2O14S/c1-14-31-43(10,52)36(48)24(4)33(45-61(53,54)29-17-15-28(44)16-18-29)22(2)20-41(8,51)38(60-40-34(47)30(46(11)12)19-23(3)56-40)25(5)35(26(6)39(50)58-31)59-32-21-42(9,55-13)37(49)27(7)57-32/h15-18,22-27,30-38,40,45,47-49,51-52H,14,19-21H2,1-13H3
• InChIKey: MMVWPYXQRNHIJB-UHFFFAOYSA-N

Properties

• Density: 1.29g/cm³ (Cal.)
• Boiling point: 929.347°C at 760 mmHg (Cal.)
• Flash point: 515.851°C (Cal.)