HMDB0041745 RDKit 3D Hesperetin 7-O-glucuronide 56 59 0 0 0 0 0 0 0 0999 V2000 7.6615 -1.8839 1.9869 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3594 -1.9982 0.6002 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2421 -1.3662 0.0947 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3822 -0.6124 0.8778 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2678 0.0026 0.3064 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9936 -0.1206 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7857 0.5600 -1.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1269 2.0271 -1.7183 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1085 2.8856 -1.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4357 4.0292 -0.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7481 2.4368 -0.8148 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3166 3.2900 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1844 4.6452 -0.9445 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 2.7865 -0.5234 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7928 1.4217 -0.3332 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0837 0.9983 -0.0993 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5404 -0.3014 0.1190 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4203 -0.6698 -0.8544 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6551 -1.0721 -0.4923 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5414 0.1203 -0.3822 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1430 1.2936 -0.6045 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8686 -0.0556 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7803 -1.9179 0.7262 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0008 -3.2657 0.4459 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5835 -1.8410 1.6458 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9511 -2.1455 2.9365 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0939 -0.3957 1.5206 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0687 -0.1326 2.4077 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6896 0.6050 -0.3943 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5738 1.0822 -0.6305 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7197 0.3052 -0.7017 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8524 -0.8704 -1.8067 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9504 -1.4788 -1.2543 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8044 -2.2340 -2.0602 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7428 -2.1449 2.5834 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8763 -0.8217 2.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5093 -2.5409 2.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5852 -0.5065 1.9371 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6124 0.5884 0.9523 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6023 0.1245 -2.5982 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1558 2.3014 -2.7966 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1284 2.2672 -1.3053 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6269 5.1605 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4571 3.4479 -0.4773 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6862 -0.9981 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0841 -1.6736 -1.3492 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3817 0.7036 0.4504 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6557 -1.5693 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9230 -3.5493 0.6653 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7559 -2.4893 1.2643 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5848 -1.4540 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9858 0.2401 1.6643 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4623 0.5448 2.0073 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8151 -0.4659 -0.2504 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6136 -0.9522 -2.8654 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6278 -2.3402 -3.0435 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 12 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 2 0 20 22 1 0 19 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 15 29 1 0 29 30 2 0 30 31 1 0 6 32 1 0 32 33 2 0 33 34 1 0 33 3 1 0 31 7 1 0 30 11 1 0 27 17 1 0 1 35 1 0 1 36 1 0 1 37 1 0 4 38 1 0 5 39 1 0 7 40 1 0 8 41 1 0 8 42 1 0 13 43 1 0 14 44 1 0 17 45 1 1 19 46 1 6 22 47 1 0 23 48 1 1 24 49 1 0 25 50 1 6 26 51 1 0 27 52 1 6 28 53 1 0 29 54 1 0 32 55 1 0 34 56 1 0 M END