Emarginatine F
[CAS# 155944-12-0]

Identification

• Name: Emarginatine F
• Synonyms: Evonine, O1-Benzoyl-O1,O2-Dideacetyl-8-Deoxo-O2-((1,6-Dihydro-1-Methyl-6-Oxo-3-Pyridinyl)Carbonyl)-8-Hydroxy-, (8Beta)-
• Molecular Formula: C₄₆H₅₀N₂O₁₈
• Molecular Weight: 918.90
• CAS Registry Number: 155944-12-0
• SMILES: C7=C(C(OC5C2(C14OC(C(C1OC(=O)C)C(O)C2OC(=O)C)(COC(=O)C3=CC=CN=C3C(C(C(OC(C4(O)C)C5OC(=O)C6=CN(C(=O)C=C6)C)=O)C)C)C)COC(=O)C)=O)C=CC=C7
• InChI: 1S/C46H50N2O18/c1-22-23(2)39(54)64-37-34(63-41(56)28-16-17-30(52)48(8)19-28)38(65-40(55)27-13-10-9-11-14-27)45(21-59-24(3)49)36(62-26(5)51)33(53)31-35(61-25(4)50)46(45,44(37,7)58)66-43(31,6)20-60-42(57)29-15-12-18-47-32(22)29/h9-19,22-23,31,33-38,53,58H,20-21H2,1-8H3
• InChIKey: RQZCESDGZDJIIK-UHFFFAOYSA-N

Properties

• Density: 1.461g/cm³ (Cal.)
• Boiling point: 931.07°C at 760 mmHg (Cal.)
• Flash point: 516.893°C (Cal.)