N-Methyl-N-D-Fructopyranosylamphotericin B Methyl Ester L-Aspartate
[CAS# 195193-90-9]

Identification

• Name: N-Methyl-N-D-Fructopyranosylamphotericin B Methyl Ester L-Aspartate
• Synonyms: Amphotericin B, N-(1-deoxy-D-fructos-1-yl)-N-methyl-, methyl ester, L-aspartate (1:1) (salt); N-(1-Deoxy-D-fructos-1-yl)-N-methylamphotericin B methyl ester L-aspartate (1:1) (salt); N-Methyl-N-D-fructopyranosylamphotericin B methyl ester L-aspartate
• Molecular Formula: C₅₉H₉₄N₂O₂₆
• Molecular Weight: 1247.38
• CAS Registry Number: 195193-90-9
• SMILES: O=C(O)C[C@H](N)C(=O)O.O=C([C@@H](O)[C@H](O)[C@H](O)CO)CN(C)[C@@H]1[C@H](O)[C@@H](O[C@H](C)[C@H]1O)O[C@H]3/C=C\C=C/C=C\C=C/C=C\C=C/C=C\[C@H](C)[C@@H](O)[C@@H](C)[C@@H](OC(=O)C[C@H](O)C[C@H](O)CC[C@@H](O)[C@H](O)C[C@H](O)C[C@@]2(O)O[C@H]([C@H](C(=O)OC)[C@@H](O)C2)C3)C
• InChI: 1S/C55H87NO22.C4H7NO4/c1-31-19-17-15-13-11-9-7-8-10-12-14-16-18-20-38(77-54-52(71)47(49(68)34(4)76-54)56(5)29-42(64)50(69)51(70)43(65)30-57)26-44-46(53(72)74-6)41(63)28-55(73,78-44)27-37(60)24-40(62)39(61)22-21-35(58)23-36(59)25-45(66)75-33(3)32(2)48(31)67;5-2(4(8)9)1-3(6)7/h7-20,31-41,43-44,46-52,54,57-63,65,67-71,73H,21-30H2,1-6H3;2H,1,5H2,(H,6,7)(H,8,9)/b8-7-,11-9-,12-10-,15-13-,16-14-,19-17-,20-18-;/t31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41-,43+,44-,46+,47-,48+,49+,50+,51+,52-,54-,55+;2-/m00/s1
• InChIKey: LIVRUDLPGREETL-YNVDHJELSA-N

Properties

• Boiling point: 1262°C at 760 mmHg (Cal.)
• Flash point: 717°C (Cal.)
• Refractive index: (Cal.)