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Molecular Formula: C96H128O64
Molecular weight: 2306.00512
InChi: InChI=1S/C96H128O64/c1-34(98)122-27-58-66-74(130-42(9)106)83(139-51(18)115)91(147-58)156-68-60(29-124-36(3)100)149-93(85(141-53(20)117)76(68)132-44(11)108)158-70-62(31-126-38(5)102)151-95(87(143-55(22)119)78(70)134-46(13)110)160-72-64(33-128-40(7)104)152-96(88(144-56(23)120)80(72)136-48(15)112)159-71-63(32-127-39(6)103)150-94(86(142-54(21)118)79(71)135-47(14)111)157-69-61(30-125-37(4)101)148-92(84(140-52(19)116)77(69)133-45(12)109)155-67-59(28-123-35(2)99)146-90(82(138-50(17)114)75(67)131-43(10)107)153-65-57(26-121-25-24-97)145-89(154-66)81(137-49(16)113)73(65)129-41(8)105/h24,57-96H,25-33H2,1-23H3/t57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73+,74+,75+,76+,77+,78+,79+,80+,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-/m1/s1
InChi Key: XKJOHFMLGHAZAH-KQYVHXRASA-N
SMILES: [C@H]12[C@@H]([C@H]([C@H](O[C@@H]1COC(=O)C)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1COC(=O)C)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1COC(=O)C)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1COC(=O)C)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](O[C@H]5[C@@H]([C@H]([C@@H](O2)O[C@@H]5COC(=O)C)OC(=O)C)OC(=O)C)O[C@@H]4COC(=O)C)OC(=O)C)OC(=O)C)O[C@@H]3COC(=O)C)OC(=O)C)OC(=O)C)O[C@@H]1COCC=O)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
Chemical Name
per-O-acetyl-6I-O-formylmethyl-γ-cyclodextrin
External Links
PubChem