Molecular Formula: C₇₇H₉₇N₂₁O₄₁

Molecular weight: 1972.71018

InChi: InChI=1S/C77H97N21O41/c1-29(99)113-58-51-44(23-86-93-79)128-73(66(58)121-37(9)107)136-53-46(25-88-95-81)130-75(68(123-39(11)109)60(53)115-31(3)101)138-55-48(27-90-97-83)132-77(70(125-41(13)111)62(55)117-33(5)103)139-56-49(28-91-98-84)131-76(69(124-40(12)110)63(56)118-34(6)104)137-54-47(26-89-96-82)129-74(67(122-38(10)108)61(54)116-32(4)102)135-52-45(24-87-94-80)127-72(65(120-36(8)106)59(52)114-30(2)100)133-50-43(22-85-92-78)126-71(134-51)64(119-35(7)105)57(50)112-21-17-20-42-18-15-14-16-19-42/h14-20,43-77H,21-28H2,1-13H3/b20-17+/t43-,44-,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-,74-,75-,76-,77-/m1/s1

InChi Key: OKRDQPUFIDUZIS-MHTSNGEHSA-N

SMILES: [C@H]12[C@@H]([C@H]([C@H](O[C@@H]1CN=N#N)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1CN=N#N)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1CN=N#N)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]5CN=N#N)OC(=O)C)OC/C=C/c2ccccc2)O[C@@H]4CN=N#N)OC(=O)C)OC(=O)C)O[C@@H]3CN=N#N)OC(=O)C)OC(=O)C)O[C@@H]1CN=N#N)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-per-6-azido-per-6-deoxy-3I-O-cinnamyl-β-cyclodextrin

External Links
PubChem

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