2-((1,2-Dihydro-5,6,17,19,21-Pentahydroxy-23-Methoxy-2,4,12,16,18,20,22-Heptamethyl-1,11-Dioxo-2,7-(Epoxypentadeca(1,11,13)Trienimino)Naphtho[2,1-b]Furan-9-Yl)Oxy)-N-Methyl-N-Morpholino-Acetamide 21-Acetate
[CAS# 17863-72-8]

Identification

• Name: 2-((1,2-Dihydro-5,6,17,19,21-Pentahydroxy-23-Methoxy-2,4,12,16,18,20,22-Heptamethyl-1,11-Dioxo-2,7-(Epoxypentadeca(1,11,13)Trienimino)Naphtho[2,1-b]Furan-9-Yl)Oxy)-N-Methyl-N-Morpholino-Acetamide 21-Acetate
• Synonyms: Brn 5418815; Rifamycin B Methylmorpholinylamide
• Molecular Formula: C₄₄H₅₉N₃O₁₄
• Molecular Weight: 853.96
• CAS Registry Number: 17863-72-8
• SMILES: C(OC1=C2C4=C(O)C(=C1)NC(=O)C(=C\C=C\C(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C(C(OC)\C=C\OC3(C)OC(=C2C3=O)C(=C4O)C)C)/C)C(=O)N(C)N5CCOCC5
• InChI: 1S/C44H59N3O14/c1-22-12-11-13-23(2)43(55)45-29-20-31(58-21-32(49)46(9)47-15-18-57-19-16-47)33-34(39(29)53)38(52)27(6)41-35(33)42(54)44(8,61-41)59-17-14-30(56-10)24(3)40(60-28(7)48)26(5)37(51)25(4)36(22)50/h11-14,17,20,22,24-26,30,36-37,40,50-53H,15-16,18-19,21H2,1-10H3,(H,45,55)/b12-11+,17-14+,23-13-
• InChIKey: KVZBIZXKBYFSRM-KZILNWOHSA-N

Properties

• Density: 1.354g/cm³ (Cal.)