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Molecular Formula: C45H68O30
Molecular weight: 1089.00342
InChi: InChI=1S/C45H68O30/c46-9-16-34-22(51)28(57)40(64-16)71-35-17(10-47)66-42(30(59)24(35)53)73-37-19(12-49)68-44(32(61)26(37)55)75-39-21(14-63-8-4-7-15-5-2-1-3-6-15)69-45(33(62)27(39)56)74-38-20(13-50)67-43(31(60)25(38)54)72-36-18(11-48)65-41(70-34)29(58)23(36)52/h1-7,16-62H,8-14H2/b7-4+/t16-,17-,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-/m1/s1
InChi Key: YLGBUBWWGQMTDF-VCDOSPSMSA-N
SMILES: [C@H]12[C@@H]([C@H]([C@H](O[C@@H]1COC/C=C/c1ccccc1)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](O2)O[C@@H]4CO)O)O)O[C@@H]3CO)O)O)O[C@@H]1CO)O)O)O)O)O)O)O)O
Chemical Name
6-O-cinnamyl-α-CD
External Links
PubChem