3a-Amino-3a-Deoxy-(2aS,3aS)-gamma-Cyclodextrin Hydrate
[CAS# 189307-64-0]

Identification

• Classification: Chemical reagent >> Organic reagent >> Cyclodextrin
• Name: 3a-Amino-3a-Deoxy-(2aS,3aS)-gamma-Cyclodextrin Hydrate
• Synonyms: 3A-Amino-3A-deoxy-(2AS,3AS)-γ-cyclodextrin Hydrate
• Molecular Formula: C₄₈H₈₁NO₃₉
• Molecular Weight: 1296.14
• CAS Registry Number: 189307-64-0
• SMILES: O[C@@H]9[C@@H](O)[C@@H]1O[C@H](CO)[C@H]9O[C@H]8O[C@H](CO)[C@@H](O[C@H]7O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O1)[C@H](O)[C@H]2O)[C@@H](N)[C@@H]3O)[C@H](O)[C@H]4O)[C@H](O)[C@H]5O)[C@H](O)[C@H]6O)[C@H](O)[C@H]7O)[C@H](O)[C@H]8O
• InChI: 1S/C48H81NO39/c49-17-18(58)41-73-9(1-50)33(17)81-42-26(66)19(59)35(11(3-52)74-42)83-44-28(68)21(61)37(13(5-54)76-44)85-46-30(70)23(63)39(15(7-56)78-46)87-48-32(72)25(65)40(16(8-57)80-48)88-47-31(71)24(64)38(14(6-55)79-47)86-45-29(69)22(62)36(12(4-53)77-45)84-43-27(67)20(60)34(82-41)10(2-51)75-43/h9-48,50-72H,1-8,49H2/t9-,10-,11-,12-,13-,14-,15-,16-,17+,18+,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-/m1/s1
• InChIKey: UCNMOVNZUVXILW-OJHPOGNJSA-N

Properties

• Density: 1.602g/cm³ (Cal.)
• Refractive index: 1.587 (Cal.)