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Molecular Formula: C73H98O47
Molecular weight: 1727.53102
InChi: InChI=1S/C73H98O47/c1-19-20-91-62-56(98-33(8)80)50-44(21-92-27(2)74)109-68(62)115-51-45(22-93-28(3)75)110-70(63(104-39(14)86)57(51)99-34(9)81)117-53-47(24-95-30(5)77)112-72(65(106-41(16)88)59(53)101-36(11)83)119-55-49(26-97-32(7)79)114-73(67(108-43(18)90)61(55)103-38(13)85)120-54-48(25-96-31(6)78)113-71(66(107-42(17)89)60(54)102-37(12)84)118-52-46(23-94-29(4)76)111-69(116-50)64(105-40(15)87)58(52)100-35(10)82/h19,44-73H,1,20-26H2,2-18H3/t44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56+,57+,58+,59+,60+,61+,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-/m1/s1
InChi Key: INFJGTBOCHKKPU-GHWFDCDYSA-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]4COC(=O)C)OC(=O)C)OC(=O)C)O[C@@H]3COC(=O)C)OC(=O)C)OC(=O)C)O[C@@H]1COC(=O)C)OCC=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-2-O-allyl-α-cyclodextrin
External Links
PubChem