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Molecular Formula: C51H78O35
Molecular weight: 1251.14402
InChi: InChI=1S/C51H78O35/c52-9-17-37-25(60)31(66)46(74-17)82-39-19(11-54)76-48(33(68)27(39)62)84-41-21(13-56)78-50(35(70)29(41)64)86-43-23(15-58)79-51(36(71)44(43)72-8-4-7-16-5-2-1-3-6-16)85-42-22(14-57)77-49(34(69)28(42)63)83-40-20(12-55)75-47(32(67)26(40)61)81-38-18(10-53)73-45(80-37)30(65)24(38)59/h1-7,17-71H,8-15H2/b7-4+/t17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-/m1/s1
InChi Key: ZWHVJXCPROEVRZ-JVWPFUNPSA-N
SMILES: [C@H]12[C@@H]([C@H]([C@H](O[C@@H]1CO)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1CO)O[C@H]1[C@@H]([C@H]([C@H](O[C@@H]1CO)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]5CO)O)O)O[C@@H]4CO)O)O)O[C@@H]3CO)O)O)O[C@@H]1CO)O)O)O)O)O)O)O)OC/C=C/c1ccccc1
Chemical Name
3-O-cinnamyl-β-cyclodextrin
External Links
PubChem