Molecular Formula: C70H90N6O20S2
Molecular weight: 1399.6218
InChi: InChI=1S/C70H90N6O20S2/c1-13-23-85-59-45-19-17-20-46(59)28-50-32-54(74-70(98)76-68-58(72-38(6)78)66(94-44(12)84)64(92-42(10)82)56(96-68)36-90-40(8)80)34-52(62(50)88-26-16-4)30-48-22-18-21-47(60(48)86-24-14-2)29-51-33-53(31-49(27-45)61(51)87-25-15-3)73-69(97)75-67-57(71-37(5)77)65(93-43(11)83)63(91-41(9)81)55(95-67)35-89-39(7)79/h17-22,31-34,55-58,63-68H,13-16,23-30,35-36H2,1-12H3,(H,71,77)(H,72,78)(H2,73,75,97)(H2,74,76,98)/t55-,56-,57-,58-,63-,64-,65-,66-,67-,68-/m1/s1
InChi Key: YSAFXSYLYUAYIY-FLMRRVAXSA-N
SMILES: [C@H]1([C@H]([C@@H](O[C@@H]([C@H]1OC(=O)C)COC(=O)C)NC(=S)Nc1cc2c(c(c1)Cc1c(c(Cc3c(c(Cc4c(c(C2)ccc4)OCCC)cc(c3)NC(=S)N[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)OCCC)ccc1)OCCC)OCCC)NC(=O)C)OC(=O)C
Chemical Name
5,17-bis[N-(2-acetamido-3,4,6-tri-O-acetyl-2-deoxy-β-D-glucopyranosyl)-thioureido]-25,26,27,28-tetrapropoxycalix[4]arene
5,17-bis[N-(2-acetamido-3,4,6-tri-O-acetyl-2-deoxy-β-D-glucopyranosyl)-thioureido]-25,26,27,28-tetrapropoxycalix[4]arene
Authors of compound