(12S,13S)-9-Deoxy-12,13-Epoxy-12,13-Dihydro-9-Oxoleucomycin V 3,4''-Diacetate
[CAS# 58880-22-1]

Identification

• Name: (12S,13S)-9-Deoxy-12,13-Epoxy-12,13-Dihydro-9-Oxoleucomycin V 3,4''-Diacetate
• Synonyms: [6-[6-[[(14E)-7-Acetoxy-8-Methoxy-3,12-Dimethyl-5,13-Dioxo-10-(2-Oxoethyl)-4,17-Dioxabicyclo[14.1.0]Heptadec-14-En-9-Yl]Oxy]-4-Dimethylamino-5-Hydroxy-2-Methyl-Tetrahydropyran-3-Yl]Oxy-4-Hydroxy-2,4-Dimethyl-Tetrahydropyran-3-Yl] Acetate; Acetic Acid [6-[[6-[[(14E)-7-Acetoxy-8-Methoxy-3,12-Dimethyl-5,13-Dioxo-10-(2-Oxoethyl)-4,17-Dioxabicyclo[14.1.0]Heptadec-14-En-9-Yl]Oxy]-4-Dimethylamino-5-Hydroxy-2-Methyl-3-Tetrahydropyranyl]Oxy]-4-Hydroxy-2,4-Dimethyl-3-Tetrahydropyranyl] Ester; Acetic Acid [6-[6-[[(14E)-7-Acetoxy-5,13-Diketo-10-(2-Ketoethyl)-8-Methoxy-3,12-Dimethyl-4,17-Dioxabicyclo[14.1.0]Heptadec-14-En-9-Yl]Oxy]-4-Dimethylamino-5-Hydroxy-2-Methyl-Tetrahydropyran-3-Yl]Oxy-4-Hydroxy-2,4-Dimethyl-Tetrahydropyran-3-Yl] Ester
• Molecular Formula: C₃₉H₆₁NO₁₆
• Molecular Weight: 799.91
• CAS Registry Number: 58880-22-1
• SMILES: C(C4C(OC2OC(C(OC1OC(C(OC(=O)C)C(O)(C1)C)C)C(N(C)C)C2O)C)C(OC)C(OC(=O)C)CC(OC(CC3OC3\C=C\C(=O)C(C4)C)C)=O)C=O
• InChI: 1S/C39H61NO16/c1-19-15-25(13-14-41)35(36(48-10)29(52-23(5)42)17-30(45)49-20(2)16-28-27(54-28)12-11-26(19)44)56-38-33(46)32(40(8)9)34(21(3)51-38)55-31-18-39(7,47)37(22(4)50-31)53-24(6)43/h11-12,14,19-22,25,27-29,31-38,46-47H,13,15-18H2,1-10H3/b12-11+
• InChIKey: BSLHJKFVBDZBEO-VAWYXSNFSA-N