HMDB0037596 RDKit 3D 8-Hydroxyluteolin 8-glucoside 3'-sulfate 57 60 0 0 0 0 0 0 0 0999 V2000 3.3860 4.2944 -1.7616 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7235 3.2599 -1.4895 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3051 2.2255 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5961 1.0918 -0.4771 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 -0.0312 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4632 0.0074 0.7409 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0071 -1.0764 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2587 -2.2048 1.7037 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7491 -3.2975 2.4031 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9571 -2.2448 1.2306 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2061 -3.3823 1.4813 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1867 -4.7084 0.4037 S 0 0 0 0 0 6 0 0 0 0 0 0 2.4939 -4.2714 -0.9881 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1626 -5.7822 0.8581 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6617 -5.4142 0.4006 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4416 -1.1731 0.5319 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3497 1.0416 -0.8898 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7204 1.9625 -1.5594 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6133 1.7793 -1.9375 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2587 0.6233 -1.5978 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9888 0.4451 -0.4009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3534 0.3821 -0.6754 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 0.3548 0.4682 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2695 1.7291 1.0948 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0495 1.6715 2.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6324 -0.6024 1.5075 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7316 -1.2750 2.0372 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -1.5828 0.8403 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -2.1161 -0.2626 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4923 -0.7260 0.3713 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8001 -0.2757 1.4819 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2827 2.7455 -2.6439 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6265 2.5660 -3.0279 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6155 3.8906 -2.9685 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7323 4.0912 -2.5936 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3403 5.2584 -2.9497 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4125 3.1259 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3377 2.3485 -0.4795 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0941 0.8616 0.5781 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -1.0361 1.8179 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6968 -3.3136 2.7698 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -6.0368 1.1829 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4209 -1.1888 0.1517 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8466 1.3785 0.1809 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1394 0.0558 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7094 2.4563 0.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2734 2.1012 1.4302 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5882 1.2184 2.9926 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1449 -0.0988 2.3726 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4843 -1.2354 1.3999 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3306 -2.3544 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6669 -2.2427 -0.9898 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9164 -1.3873 -0.2923 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5337 -1.0586 2.0516 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 3.2528 -3.5368 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0924 4.6838 -3.5223 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1982 5.6613 -2.8449 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 2 0 12 15 1 0 10 16 2 0 4 17 1 0 17 18 1 0 18 19 2 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 1 0 32 33 1 0 32 34 2 0 34 35 1 0 35 36 1 0 35 37 2 0 37 2 1 0 16 5 1 0 37 18 1 0 30 21 1 0 3 38 1 0 6 39 1 0 7 40 1 0 9 41 1 0 15 42 1 0 16 43 1 0 21 44 1 0 23 45 1 0 24 46 1 0 24 47 1 0 25 48 1 0 26 49 1 0 27 50 1 0 28 51 1 0 29 52 1 0 30 53 1 0 31 54 1 0 33 55 1 0 34 56 1 0 36 57 1 0 M END