HMDB0037932 RDKit 3D Quercetin 4'-glucoside 53 56 0 0 0 0 0 0 0 0999 V2000 5.9138 -0.5722 2.8552 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2941 -0.3468 1.7958 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8855 -0.3288 1.8551 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2767 -0.5595 3.0699 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1743 -0.0877 0.7244 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -0.0508 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 0.1708 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2499 0.2244 -0.7217 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1198 0.0669 0.3258 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 0.1101 0.2266 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2561 0.3110 -0.9163 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0615 1.4403 -0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3703 1.2442 -0.5340 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.5939 1.0575 0.9729 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9699 0.8620 1.1342 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1232 0.2563 -1.3610 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1452 0.7833 -2.1145 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1084 -0.4680 -2.2569 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7505 -1.4808 -2.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0408 -0.9471 -1.2840 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2075 -1.8594 -1.8918 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -0.1523 1.5673 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3648 -0.3153 2.6471 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8547 -0.2053 1.7159 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8507 0.1264 -0.4149 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 0.1177 -0.5094 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7697 0.3495 -1.7358 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1285 0.3455 -1.8631 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7637 0.5792 -3.0903 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9127 0.1095 -0.7711 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3123 -0.1294 0.4874 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1072 -0.3607 1.5546 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9374 -0.1215 0.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7956 -0.7418 3.9115 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7607 0.3015 -1.4261 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6775 0.3984 -1.7131 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5866 0.4758 -1.7821 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8784 2.2416 -0.7346 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9701 0.2813 1.4076 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3701 2.0630 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3623 1.3415 1.8823 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5702 -0.5678 -0.7337 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4474 0.1382 -2.7803 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6799 0.3145 -2.9253 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6165 -2.3475 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 -1.3499 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -2.5390 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9613 -0.4742 3.5558 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2659 -0.3755 2.7052 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1753 0.5351 -2.6005 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7636 0.5762 -3.1851 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 0.1000 -0.8515 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0573 -0.5404 2.4899 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 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 13 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 9 22 1 0 22 23 1 0 22 24 2 0 5 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 1 0 28 30 2 0 30 31 1 0 31 32 1 0 31 33 2 0 33 2 1 0 24 6 1 0 33 26 1 0 20 11 1 0 4 34 1 0 7 35 1 0 8 36 1 0 11 37 1 6 13 38 1 6 14 39 1 0 14 40 1 0 15 41 1 0 16 42 1 1 17 43 1 0 18 44 1 6 19 45 1 0 20 46 1 1 21 47 1 0 23 48 1 0 24 49 1 0 27 50 1 0 29 51 1 0 30 52 1 0 32 53 1 0 M END