Molecular Formula: C57H84ClN5O35
Molecular weight: 1434.74236
InChi: InChI=1S/C57H83N5O31.ClHO4/c1-9-61-23-13-11-10-12-22(23)59-48-26(61)49(78)60(8)57(79)62(48)15-25(63)58-14-24-47-33(70)40(77)56(86-24)92-46-21(7)84-54(38(75)31(46)68)90-44-19(5)82-52(36(73)29(44)66)88-42-17(3)80-50(34(71)27(42)64)87-41-16(2)81-51(35(72)28(41)65)89-43-18(4)83-53(37(74)30(43)67)91-45-20(6)85-55(93-47)39(76)32(45)69;2-1(3,4)5/h10-13,16-21,24,27-47,50-56,64-77H,9,14-15H2,1-8H3;(H,2,3,4,5)/t16-,17-,18-,19-,20-,21-,24-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,50-,51-,52-,53-,54-,55-,56-;/m1./s1
InChi Key: IMRVYQWJZRWGON-ZVRGUORWSA-N
SMILES: c12c(n(c(=O)n(c2=O)C)CC(=O)NC[C@@H]2[C@@H]3[C@@H]([C@H]([C@H](O2)O[C@H]2[C@@H]([C@H]([C@H](O[C@@H]2C)O[C@H]2[C@@H]([C@H]([C@H](O[C@@H]2C)O[C@H]2[C@@H]([C@H]([C@H](O[C@@H]2C)O[C@H]2[C@@H]([C@H]([C@@H](O[C@H]4[C@@H]([C@H]([C@@H](O[C@H]5[C@@H]([C@H]([C@@H](O3)O[C@@H]5C)O)O)O[C@@H]4C)O)O)O[C@@H]2C)O)O)O)O)O)O)O)O)O)O)nc2c([n+]1CC)cccc2.[Cl](=O)(=O)(=O)[O-]
Chemical Name
1-{[N-(6-deoxy-β-cyclodextrin-6-yl)carbamoyl]methyl}-5-ethyl-3-methylalloxazin-5-ium perchlorate
1-{[N-(6-deoxy-β-cyclodextrin-6-yl)carbamoyl]methyl}-5-ethyl-3-methylalloxazin-5-ium perchlorate
Authors of compound