Methyl 33-[(3-Acetamido-3,6-Dideoxyhexopyranosyl)Oxy]-1,3,5,6,9,11,17,37-Octahydroxy-15,16,18-Trimethyl-13-Oxo-14,39-Dioxabicyclo[33.3.1]Nonatriaconta-19,21,23,25,27,29,31-Heptaene-36-Carboxylate
[CAS# 62008-36-0]

Identification

• Name: Methyl 33-[(3-Acetamido-3,6-Dideoxyhexopyranosyl)Oxy]-1,3,5,6,9,11,17,37-Octahydroxy-15,16,18-Trimethyl-13-Oxo-14,39-Dioxabicyclo[33.3.1]Nonatriaconta-19,21,23,25,27,29,31-Heptaene-36-Carboxylate
• Synonyms: Amphotericin B, N-acetyl-, methyl ester; N-Acetyl methyl ester amb; N-Acetylamphotericin B methyl ester
• Molecular Formula: C₅₀H₇₇NO₁₈
• Molecular Weight: 980.14
• CAS Registry Number: 62008-36-0
• SMILES: O=C(NC1C(O)C(OC(C)C1O)OC3/C=C/C=C\C=C/C=C\C=C/C=C\C=C/C(C)C(O)C(C)C(OC(=O)CC(O)CC(O)CCC(O)C(O)CC(O)CC2(O)OC(C(C(=O)OC)C(O)C2)C3)C)C
• InChI: 1S/C50H77NO18/c1-29-19-17-15-13-11-9-7-8-10-12-14-16-18-20-37(68-49-47(62)44(51-33(5)52)46(61)32(4)67-49)26-41-43(48(63)65-6)40(58)28-50(64,69-41)27-36(55)24-39(57)38(56)22-21-34(53)23-35(54)25-42(59)66-31(3)30(2)45(29)60/h7-20,29-32,34-41,43-47,49,53-58,60-62,64H,21-28H2,1-6H3,(H,51,52)/b8-7+,11-9+,12-10-,15-13+,16-14+,19-17+,20-18+
• InChIKey: NDVSCMLXIAPNEI-WVYXAZEGSA-N

Properties

• Density: 1.313g/cm³ (Cal.)
• Boiling point: 1162.403°C at 760 mmHg (Cal.)
• Flash point: 656.797°C (Cal.)