Marvin 07081016002D 73 81 0 0 1 0 999 V2000 12.0935 -21.9916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9396 -21.3185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7888 -21.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6324 -21.3174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6386 -19.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9458 -19.9853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7954 -17.9881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9460 -17.3306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9511 -16.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1027 -15.3371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2558 -15.9998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2574 -17.3345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1058 -17.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4106 -17.9971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5620 -17.3319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5605 -15.9971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4073 -15.3344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4125 -13.9997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5641 -13.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7171 -13.9970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7187 -15.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9824 -15.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7680 -14.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9866 -13.5884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3922 -12.3181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6104 -11.2412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3963 -10.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9810 -8.8930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6599 -10.5748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6615 -11.9093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8568 -16.6554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8521 -12.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5625 -11.9997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2543 -14.6717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4816 -21.9803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7861 -23.3205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9367 -23.9876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9330 -25.3223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0836 -25.9895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2378 -25.3286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2413 -23.9939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0909 -23.3268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4022 -23.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3950 -25.9957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5492 -25.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6996 -26.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8538 -25.3411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8574 -24.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7069 -23.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5527 -24.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7105 -22.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0183 -23.3456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1688 -24.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3229 -23.3451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4735 -24.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4698 -25.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3157 -26.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1652 -25.3474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3121 -27.3424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4627 -28.0162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.6272 -26.0207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.6343 -23.3513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3265 -22.0170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0110 -26.0081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0799 -27.3241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2643 -18.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6005 -14.6700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4809 -16.6597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6527 -22.6820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2488 -26.6634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9577 -22.6769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7894 -19.3213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9434 -18.6585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 72 1 0 0 0 0 72 6 1 0 0 0 0 2 6 1 0 0 0 0 72 7 1 0 0 0 0 8 7 1 1 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 8 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 16 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 20 24 1 0 0 0 0 24 25 1 1 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 25 30 1 0 0 0 0 21 31 1 1 0 0 0 20 32 1 1 0 0 0 19 33 1 1 0 0 0 11 34 1 1 0 0 0 4 35 1 1 0 0 0 3 36 1 0 0 0 0 37 36 1 6 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 37 42 1 0 0 0 0 41 43 1 6 0 0 0 40 44 1 0 0 0 0 45 44 1 6 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 45 50 1 0 0 0 0 49 51 1 6 0 0 0 48 52 1 0 0 0 0 53 52 1 1 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 53 58 1 0 0 0 0 57 59 1 1 0 0 0 59 60 1 0 0 0 0 56 61 1 6 0 0 0 55 62 1 1 0 0 0 54 63 1 6 0 0 0 47 64 1 1 0 0 0 39 65 1 1 0 0 0 12 66 1 1 0 0 0 16 67 1 1 0 0 0 17 68 1 6 0 0 0 3 69 1 6 0 0 0 40 70 1 6 0 0 0 48 71 1 6 0 0 0 72 73 1 1 0 0 0 M END > CHEBI:31468 > deslanoside > A cardenolide glycoside that is lanatoside C with the acetoxy group replaced by a hydroxy group. > 3 > CHEBI:565356 > glucodigoxin; desacetyllanatoside C; deacetyllanatoside C; 3-[(O-beta-D-glucopyranosyl-(1->4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy]-12,14-dihydroxy-3beta,5beta,12beta-card-20(22)-enolide; (3beta,5beta,12beta)-3-{[beta-D-glucopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl]oxy}-12,14-dihydroxycard-20(22)-enolide > 3beta-{[beta-D-glucopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl]oxy}-12beta,14-dihydroxy-5beta-card-20(22)-enolide > deslanosidum; deslanosido; deslanoside > C47H74O19 > 943.07910 > 942.48243 > 0 > [H][C@@]1(C[C@H](O)[C@]([H])(O[C@H]2C[C@H](O)[C@]([H])(O[C@H]3C[C@H](O)[C@]([H])(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](C)O3)[C@@H](C)O2)[C@@H](C)O1)O[C@H]1CC[C@@]2(C)[C@]([H])(CC[C@]3([H])[C@]2([H])C[C@@H](O)[C@]2(C)[C@H](CC[C@]32O)C2=CC(=O)OC2)C1 > InChI=1S/C47H74O19/c1-20-41(64-36-16-30(50)42(21(2)60-36)65-37-17-31(51)43(22(3)61-37)66-44-40(56)39(55)38(54)32(18-48)63-44)29(49)15-35(59-20)62-25-8-10-45(4)24(13-25)6-7-27-28(45)14-33(52)46(5)26(9-11-47(27,46)57)23-12-34(53)58-19-23/h12,20-22,24-33,35-44,48-52,54-57H,6-11,13-19H2,1-5H3/t20-,21-,22-,24-,25+,26-,27-,28+,29+,30+,31+,32-,33-,35+,36+,37+,38-,39+,40-,41-,42-,43-,44+,45+,46+,47+/m1/s1 > OBATZBGFDSVCJD-LALPQLPRSA-N > 78187 > 17598-65-1 > 17598-65-1 > DB01078 > D01240 > Deslanoside > 13594846; 241837; 7182446 $$$$