Midecamycin
[CAS# 35457-80-8]

Identification

• Classification: API >> Antibiotics >> Macrolide drug
• Name: Midecamycin
• Synonyms: [(2R,3R,4R,6S)-6-[(2R,3S,4R,5R,6S)-4-Dimethylamino-5-Hydroxy-6-[[(11Z,13E)-10-Hydroxy-5-Methoxy-9,16-Dimethyl-2-Oxo-7-(2-Oxoethyl)-4-Propanoyloxy-1-Oxacyclohexadeca-11,13-Dien-6-Yl]Oxy]-2-Methyl-Tetrahydropyran-3-Yl]Oxy-4-Hydroxy-2,4-Dimethyl-Tetrahydropyran-3-Yl] Propanoate; Propanoic Acid [(2R,3R,4R,6S)-6-[[(2R,3S,4R,5R,6S)-4-Dimethylamino-5-Hydroxy-6-[[(11Z,13E)-10-Hydroxy-5-Methoxy-9,16-Dimethyl-2-Oxo-7-(2-Oxoethyl)-4-(1-Oxopropoxy)-1-Oxacyclohexadeca-11,13-Dien-6-Yl]Oxy]-2-Methyl-3-Tetrahydropyranyl]Oxy]-4-Hydroxy-2,4-Dimethyl-3-Tetrahydropyranyl] Ester; Propionic Acid [(2R,3R,4R,6S)-6-[(2R,3S,4R,5R,6S)-4-Dimethylamino-5-Hydroxy-6-[[(11Z,13E)-10-Hydroxy-2-Keto-7-(2-Ketoethyl)-5-Methoxy-9,16-Dimethyl-4-Propionyloxy-1-Oxacyclohexadeca-11,13-Dien-6-Yl]Oxy]-2-Methyl-Tetrahydropyran-3-Yl]Oxy-4-Hydroxy-2,4-Dimethyl-Tetrahydropyran-3-Yl] Ester
• Molecular Formula: C₄₁H₆₇NO₁₅
• Molecular Weight: 813.98
• CAS Registry Number: 35457-80-8
• EINECS: 252-578-0
• SMILES: [C@H]2(O[C@@H]1O[C@@H]([C@@H](OC(=O)CC)[C@](O)(C1)C)C)[C@H](N(C)C)[C@@H](O)[C@@H](O[C@@H]2C)OC3C(OC)C(OC(=O)CC)CC(OC(C\C=C\C=C/C(O)C(CC3CC=O)C)C)=O
• InChI: 1S/C41H67NO15/c1-11-30(45)54-29-21-32(47)51-24(4)16-14-13-15-17-28(44)23(3)20-27(18-19-43)37(38(29)50-10)57-40-35(48)34(42(8)9)36(25(5)53-40)56-33-22-41(7,49)39(26(6)52-33)55-31(46)12-2/h13-15,17,19,23-29,33-40,44,48-49H,11-12,16,18,20-22H2,1-10H3/b14-13+,17-15-/t23?,24?,25-,26-,27?,28?,29?,33+,34-,35-,36-,37?,38?,39-,40+,41-/m1/s1
• InChIKey: DMUAPQTXSSNEDD-ZZHFWOCQSA-N

Properties

• Density: 1.219g/cm³ (Cal.)
• Boiling point: 874.035°C at 760 mmHg (Cal.)
• Flash point: 482.399°C (Cal.)