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Molecular Formula: C72H96O49
Molecular weight: 1745.50324
InChi: InChI=1S/C72H96O49/c1-25(73)93-19-43-50-56(99-31(7)79)63(106-38(14)86)69(112-43)119-52-45(21-95-27(3)75)114-71(65(108-40(16)88)58(52)101-33(9)81)121-54-47(23-97-29(5)77)115-72(66(109-41(17)89)60(54)103-35(11)83)120-53-46(22-96-28(4)76)113-70(64(107-39(15)87)59(53)102-34(10)82)118-51-44(20-94-26(2)74)111-68(62(105-37(13)85)57(51)100-32(8)80)116-49-42(18-92-24-48(90)91)110-67(117-50)61(104-36(12)84)55(49)98-30(6)78/h42-47,49-72H,18-24H2,1-17H3,(H,90,91)/t42-,43-,44-,45-,46-,47-,49-,50-,51-,52-,53-,54-,55+,56+,57+,58+,59+,60+,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-/m1/s1
InChi Key: NPJJUCCBISALIU-KNOPVKDVSA-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]3[C@@H]([C@H]([C@@H](O[C@H]4[C@@H]([C@H]([C@@H](O2)O[C@@H]4COCC(=O)O)OC(=O)C)OC(=O)C)O[C@@H]3COC(=O)C)OC(=O)C)OC(=O)C)O[C@@H]1COC(=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-6-O-carboxymethyl-α-cyclodextrin
External Links
PubChem