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Molecular Formula: C70H91N21O43
Molecular weight: 1914.58644
InChi: InChI=1S/C70H91N21O43/c1-22(92)108-51-44-36(15-79-86-72)123-66(59(51)116-30(9)100)131-46-38(17-81-88-74)125-68(61(118-32(11)102)53(46)110-24(3)94)133-48-40(19-83-90-76)127-70(63(120-34(13)104)55(48)112-26(5)96)134-49-41(20-84-91-77)126-69(62(119-33(12)103)56(49)113-27(6)97)132-47-39(18-82-89-75)124-67(60(117-31(10)101)54(47)111-25(4)95)130-45-37(16-80-87-73)122-65(58(115-29(8)99)52(45)109-23(2)93)128-43-35(14-78-85-71)121-64(129-44)57(114-28(7)98)50(43)107-21-42(105)106/h35-41,43-70H,14-21H2,1-13H3,(H,105,106)/t35-,36-,37-,38-,39-,40-,41-,43-,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-/m1/s1
InChi Key: OWLWCUVIJGDLHG-QQTBTKRASA-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)OCC(=O)O)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-carboxymethyl-β-cyclodextrin
External Links
PubChem