Molecular Formula: C₅₇H₈₅N₅O₃₁

Molecular weight: 1336.2997

InChi: InChI=1S/C57H85N5O31/c1-9-61-23-13-11-10-12-22(23)60(8)48-26(61)49(78)62(57(79)59-48)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/h10-13,16-21,24,27-47,50-56,64-77H,9,14-15H2,1-8H3,(H,58,63)(H,59,79)/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: ZKFNCQAAKWWGKH-HQXAZROKSA-N

SMILES: c12c(n(c3c(n1CC)cccc3)C)[nH]c(=O)n(c2=O)CC(=O)NC[C@@H]1[C@@H]2[C@@H]([C@H]([C@H](O1)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1C)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1C)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1C)O[C@H]1[C@@H]([C@H]([C@@H](O[C@H]3[C@@H]([C@H]([C@@H](O[C@H]4[C@@H]([C@H]([C@@H](O2)O[C@@H]4C)O)O)O[C@@H]3C)O)O)O[C@@H]1C)O)O)O)O)O)O)O)O)O)O

Chemical Name
N-(6-deoxy-β-cyclodextrin-6-yl)-2-(5-ethyl-5,10-dihydro-10-methylisoalloxazin-3-yl)acetamide

External Links
PubChem

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