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Molecular Formula: C49H69N5O32
Molecular weight: 1240.08646
InChi: InChI=1S/C49H69N5O32/c1-53-42(73)22-41(52-14-5-3-2-4-13(14)51-22)54(49(53)74)7-21(60)50-6-15-35-23(61)29(67)43(75-15)82-36-16(8-55)77-45(31(69)25(36)63)84-38-18(10-57)79-47(33(71)27(38)65)86-40-20(12-59)80-48(34(72)28(40)66)85-39-19(11-58)78-46(32(70)26(39)64)83-37-17(9-56)76-44(81-35)30(68)24(37)62/h2-5,15-20,23-40,43-48,55-59,61-72H,6-12H2,1H3,(H,50,60)/t15-,16-,17-,18-,19-,20-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,43-,44-,45-,46-,47-,48-/m1/s1
InChi Key: NWTMIYGRLUQNJB-RCVFNXEWSA-N
SMILES: c12c(c(=O)n(c(=O)n1CC(=O)NC[C@@H]1[C@@H]3[C@@H]([C@H]([C@H](O1)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1CO)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1CO)O[C@H]1[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]5CO)O)O)O[C@@H]4CO)O)O)O[C@@H]1CO)O)O)O)O)O)O)O)O)C)nc1c(n2)cccc1
Chemical Name
N-(6-deoxy-α-cyclodextrin-6-yl) 2-(3-methylalloxazin-1-yl)acetamide
External Links
PubChem