HMDB0032908 RDKit 3D Kaempferol 7-sophoroside 73 77 0 0 0 0 0 0 0 0999 V2000 6.0790 -2.0804 -0.5756 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4301 -1.0768 -0.1922 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0651 0.1169 0.1551 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4376 0.1509 0.0612 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3696 1.2118 0.5719 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9372 2.5060 0.9595 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0552 3.5037 1.4083 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4977 4.7395 1.7915 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8406 5.0512 1.7495 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2874 6.3124 2.1414 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 4.0714 1.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2524 2.7940 0.9118 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0468 1.0614 0.6237 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4057 -0.0261 0.3122 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0224 -0.0879 0.3991 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2944 -1.2189 0.0809 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -1.1849 0.1977 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9588 -2.2137 -0.0784 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6329 -2.5653 1.0956 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5894 -3.5219 0.9771 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4289 -4.6329 2.0222 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -5.2631 1.9013 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7038 -4.0765 -0.3997 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -4.9742 -0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8286 -3.0035 -1.4567 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1712 -2.6980 -1.6114 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -1.7468 -1.0273 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9698 -0.9728 -0.3422 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1954 0.2896 -0.8833 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5061 0.4935 -1.2286 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6831 1.8284 -1.5727 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8973 2.0158 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0648 1.5805 -1.8076 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7816 2.6807 -0.3239 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0985 2.8512 0.0929 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9313 2.0069 0.7403 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4807 2.8966 1.7012 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7312 1.3880 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0543 2.4105 -0.6127 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9748 -2.3237 -0.3377 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3772 -2.3187 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 -3.4249 -0.8676 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0678 -1.1628 -0.1159 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9788 -0.6190 -0.2342 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 3.2690 1.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8104 5.5165 2.1409 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3439 7.0364 1.4309 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7629 4.2605 1.2542 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9817 2.0788 0.5759 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5092 0.8262 0.7416 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4301 -3.0710 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5663 -3.0299 1.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2349 -5.3905 1.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5371 -4.1838 3.0328 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2118 -6.0611 1.3363 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6764 -4.6536 -0.4286 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -5.0232 -1.7194 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4389 -3.4196 -2.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6401 -2.7071 -0.7254 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6098 -1.3262 -1.9082 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5666 0.3747 -1.7928 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7975 2.1664 -2.1371 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7786 1.3881 -3.3665 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9887 3.0623 -2.7478 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7729 1.4259 -2.4698 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3575 3.6949 -0.4873 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2747 2.4101 0.9634 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 1.2181 1.2876 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7005 2.6042 2.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0094 0.9839 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2772 3.3076 -0.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5064 -3.2357 -0.6017 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6186 -4.2899 -1.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 3 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 11 1 0 11 12 2 0 5 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 20 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 31 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 16 40 2 0 40 41 1 0 41 42 1 0 41 43 2 0 43 2 1 0 12 6 1 0 43 14 1 0 27 18 1 0 38 29 1 0 4 44 1 0 7 45 1 0 8 46 1 0 10 47 1 0 11 48 1 0 12 49 1 0 15 50 1 0 18 51 1 0 20 52 1 0 21 53 1 0 21 54 1 0 22 55 1 0 23 56 1 0 24 57 1 0 25 58 1 0 26 59 1 0 27 60 1 0 29 61 1 0 31 62 1 0 32 63 1 0 32 64 1 0 33 65 1 0 34 66 1 0 35 67 1 0 36 68 1 0 37 69 1 0 38 70 1 0 39 71 1 0 40 72 1 0 42 73 1 0 M END