HMDB0128507 RDKit 3D 3,4,5-trihydroxy-6-{4-[(E)-2-(3-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl... 70 73 0 0 0 0 0 0 0 0999 V2000 6.2181 4.5149 -0.2704 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0819 3.4264 -0.8849 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9567 3.2095 -1.6389 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 2.4245 -0.7427 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9603 1.2650 -1.4411 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3620 0.2479 -0.6954 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1971 0.7361 -0.1239 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9072 0.3157 -0.3053 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8883 0.9444 0.3767 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5632 0.5234 0.1994 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2693 -0.5216 -0.6575 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1217 -0.9122 -0.8015 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5842 -1.8661 -1.5697 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9566 -2.2802 -1.7371 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2414 -3.3232 -2.6204 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5211 -3.7477 -2.8173 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -4.7876 -3.7024 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5498 -3.1167 -2.1155 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2962 -2.0885 -1.2407 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3206 -1.4961 -0.5742 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3154 -0.4710 0.3566 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1318 0.5695 -0.0855 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3930 1.5114 0.8785 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1844 2.3369 1.2674 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6252 3.2361 2.2494 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0673 0.9842 2.1052 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2672 1.2561 3.2086 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1997 -0.5231 1.9677 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6664 -1.0883 3.1505 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8310 -1.0689 1.6715 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9391 -0.8279 2.7018 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9962 -1.6837 -1.0638 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -1.1381 -1.3283 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6131 -0.7146 -1.1496 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2686 -0.2071 0.4509 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9540 -1.3711 0.1204 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2034 0.8765 0.8841 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3733 0.7628 0.1004 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5711 2.2213 0.6893 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4919 2.3208 1.5646 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9196 2.6942 -2.5054 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0744 2.9197 -1.2379 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2653 -0.6084 -1.3626 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0624 1.7643 1.0567 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7881 1.0390 0.7491 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8971 -0.3762 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1788 -2.4067 -2.1512 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -3.8209 -3.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7187 -5.1160 -3.8604 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5402 -3.4712 -2.2915 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3401 -0.0309 0.5802 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1143 2.2411 0.3942 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7822 2.9316 0.4255 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4284 1.6888 1.7403 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5737 3.5008 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0527 1.4629 2.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7718 1.3037 4.0593 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8598 -0.7264 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5248 -1.5314 2.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9098 -2.1918 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9576 -1.5650 3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7911 -0.8700 -0.3713 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0853 -1.9530 -2.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3837 -1.2269 -1.6971 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -0.4639 1.3361 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4872 -1.7727 -0.6686 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4394 0.7283 1.9551 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1016 0.5413 -0.8296 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2905 3.0205 1.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6238 1.8456 2.4054 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 23 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 19 32 2 0 11 33 1 0 33 34 2 0 6 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 39 4 1 0 34 8 1 0 32 14 1 0 30 21 1 0 3 41 1 0 4 42 1 0 6 43 1 0 9 44 1 0 10 45 1 0 12 46 1 0 13 47 1 0 15 48 1 0 17 49 1 0 18 50 1 0 21 51 1 0 23 52 1 0 24 53 1 0 24 54 1 0 25 55 1 0 26 56 1 0 27 57 1 0 28 58 1 0 29 59 1 0 30 60 1 0 31 61 1 0 32 62 1 0 33 63 1 0 34 64 1 0 35 65 1 0 36 66 1 0 37 67 1 0 38 68 1 0 39 69 1 0 40 70 1 0 M END