Marvin 05111013292D 88 96 0 0 1 0 999 V2000 9.1100 -11.0800 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1100 -10.2366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3721 -11.5017 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3721 -9.8677 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6868 -11.0800 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6868 -10.2366 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7952 -11.5017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4805 -11.0800 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7952 -9.8677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4805 -10.2366 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2184 -11.5017 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.9037 -11.0800 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.2184 -9.8677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9037 -10.2366 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3721 -9.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7952 -9.0243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1100 -8.6553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7983 -8.4445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3766 -7.7065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5889 -8.4445 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6416 -9.8677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0106 -9.1297 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0016 -8.4445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9489 -9.8677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5799 -9.1297 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5799 -7.7592 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7365 -7.7065 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7365 -9.1297 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3676 -8.4445 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7923 -7.0213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9489 -7.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7983 -7.0213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2140 -6.3360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0106 -7.7065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5889 -7.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8540 -7.7065 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.8012 -9.1297 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.2229 -8.4445 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.0106 -6.3360 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.2229 -7.0213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8012 -6.3360 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5889 -5.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7923 -5.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0016 -5.5981 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5799 -6.3360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7365 -6.3360 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3149 -7.0213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5799 -4.9129 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3149 -5.5981 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7365 -4.9129 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.0106 -4.9129 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0016 -4.1749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2229 -5.5981 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.8012 -4.9129 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3721 -12.2924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2184 -12.2924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6416 -11.5017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9489 -11.5017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2757 -9.8150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0663 -8.3918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0663 -5.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2229 -4.1749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3676 -4.1749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5242 -5.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5242 -8.4445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3149 -9.8677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5889 -4.1749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4805 -5.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7425 -5.0183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1657 -5.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1657 -4.1749 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.8510 -3.8059 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4805 -3.8059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7425 -4.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0573 -3.8059 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3721 -4.1749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6341 -3.8059 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0573 -2.9626 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6341 -2.9626 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3721 -2.5409 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4805 -2.9626 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7425 -2.5409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8510 -2.9626 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1657 -2.5409 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5889 -2.5409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1657 -1.7503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3721 -1.7503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9489 -2.5409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 1 1 0 0 0 0 1 7 1 6 0 0 0 2 1 1 0 0 0 0 4 2 1 0 0 0 0 5 3 1 0 0 0 0 3 55 1 6 0 0 0 4 15 1 1 0 0 0 6 4 1 0 0 0 0 6 5 1 0 0 0 0 5 58 1 1 0 0 0 6 24 1 6 0 0 0 8 7 1 6 0 0 0 11 8 1 0 0 0 0 10 8 1 0 0 0 0 10 9 1 1 0 0 0 16 9 1 0 0 0 0 13 10 1 0 0 0 0 12 11 1 0 0 0 0 11 56 1 1 0 0 0 14 12 1 0 0 0 0 12 57 1 6 0 0 0 14 13 1 0 0 0 0 14 21 1 6 0 0 0 17 15 1 0 0 0 0 20 18 1 1 0 0 0 19 18 1 0 0 0 0 34 20 1 0 0 0 0 22 20 1 0 0 0 0 22 21 1 6 0 0 0 37 22 1 0 0 0 0 25 23 1 0 0 0 0 26 23 1 0 0 0 0 25 24 1 6 0 0 0 28 25 1 0 0 0 0 26 31 1 1 0 0 0 27 26 1 0 0 0 0 29 27 1 0 0 0 0 27 47 1 6 0 0 0 29 28 1 0 0 0 0 28 66 1 6 0 0 0 29 65 1 1 0 0 0 31 30 1 0 0 0 0 35 32 1 0 0 0 0 43 33 1 0 0 0 0 36 34 1 0 0 0 0 39 35 1 1 0 0 0 38 36 1 0 0 0 0 36 40 1 6 0 0 0 38 37 1 0 0 0 0 37 59 1 1 0 0 0 38 60 1 6 0 0 0 41 39 1 0 0 0 0 42 39 1 0 0 0 0 41 40 1 6 0 0 0 53 41 1 0 0 0 0 51 42 1 0 0 0 0 44 43 1 1 0 0 0 45 44 1 0 0 0 0 48 44 1 0 0 0 0 46 45 1 0 0 0 0 46 47 1 6 0 0 0 49 46 1 0 0 0 0 50 48 1 0 0 0 0 48 52 1 6 0 0 0 50 49 1 0 0 0 0 49 64 1 6 0 0 0 50 63 1 1 0 0 0 54 51 1 0 0 0 0 51 67 1 6 0 0 0 77 52 1 6 0 0 0 54 53 1 0 0 0 0 53 61 1 1 0 0 0 54 62 1 6 0 0 0 72 67 1 6 0 0 0 70 68 1 0 0 0 0 74 69 1 0 0 0 0 71 70 1 1 0 0 0 72 71 1 0 0 0 0 73 71 1 0 0 0 0 83 72 1 0 0 0 0 81 73 1 0 0 0 0 75 74 1 1 0 0 0 76 75 1 0 0 0 0 78 75 1 0 0 0 0 77 76 1 0 0 0 0 79 77 1 0 0 0 0 80 78 1 0 0 0 0 78 82 1 6 0 0 0 80 79 1 0 0 0 0 79 88 1 6 0 0 0 80 87 1 1 0 0 0 81 82 1 6 0 0 0 84 81 1 0 0 0 0 84 83 1 0 0 0 0 83 85 1 1 0 0 0 84 86 1 6 0 0 0 M END > CHEBI:495056 > gamma-cyclodextrin > A cycloamylose composed of eight α-(1→4) linked D-glucopyranose units. > 3 > gamma-cyclodextrin; gamma-CD; cyclooctaamylose > cyclomaltooctaose > C48H80O40 > 1297.12480 > 1296.42259 > 0 > OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@@H]9[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O > InChI=1S/C48H80O40/c49-1-9-33-17(57)25(65)41(73-9)82-34-10(2-50)75-43(27(67)19(34)59)84-36-12(4-52)77-45(29(69)21(36)61)86-38-14(6-54)79-47(31(71)23(38)63)88-40-16(8-56)80-48(32(72)24(40)64)87-39-15(7-55)78-46(30(70)22(39)62)85-37-13(5-53)76-44(28(68)20(37)60)83-35-11(3-51)74-42(81-33)26(66)18(35)58/h9-72H,1-8H2/t9-,10-,11-,12-,13-,14-,15-,16-,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-,46-,47-,48-/m1/s1 > GDSRMADSINPKSL-HSEONFRVSA-N > 78740 > 17465-86-0 > 17465-86-0 > 17465-86-0 > 17234420 $$$$