HMDB0041591 RDKit 3D Apigenin 4'-O-glucoside 51 54 0 0 0 0 0 0 0 0999 V2000 5.6056 -2.8479 -0.5534 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1951 -1.6836 -0.3371 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8361 -1.4612 -0.2693 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2675 -0.2385 -0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8237 -0.0120 0.0309 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3022 1.2508 0.2671 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 1.4841 0.3368 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9647 0.4402 0.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3132 0.6835 0.2405 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3707 -0.2117 0.1025 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1395 0.1340 -1.0059 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4648 -0.2694 -0.8545 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.1807 -0.3154 -2.1826 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5148 -1.2206 -2.9929 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1019 0.7303 0.0891 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4703 0.5017 0.2397 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3567 0.6452 1.3837 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0198 1.9295 1.8426 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1867 -0.2746 1.3701 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5370 -1.5848 1.6889 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4633 -0.8134 -0.0649 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9267 -1.0262 -0.1316 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1051 0.7611 0.1217 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4009 0.6148 0.0688 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2307 1.7269 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5941 1.5794 0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3834 2.7228 0.3832 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2022 0.3725 -0.0324 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3882 -0.7614 -0.2179 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0013 -1.9433 -0.4415 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0361 -0.5952 -0.1603 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1997 -2.3184 -0.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9975 2.0689 0.3988 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4689 2.4707 0.5215 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -1.2437 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5026 -1.2916 -0.4181 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2704 0.6743 -2.6456 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1967 -0.7454 -1.9847 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 -1.9563 -2.4786 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9147 1.7550 -0.3401 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6736 0.6690 1.2098 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0865 0.2506 2.1494 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 1.9144 2.3878 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4966 0.0577 2.2009 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9799 -2.2470 1.2023 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -1.6627 -0.2031 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2355 -2.0547 -0.3216 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7614 2.6830 0.4303 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6343 3.2691 -0.4306 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2861 0.2497 -0.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7537 -2.8607 -0.6001 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 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 12 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 8 21 1 0 21 22 2 0 4 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 1 0 26 28 2 0 28 29 1 0 29 30 1 0 29 31 2 0 31 2 1 0 22 5 1 0 31 24 1 0 19 10 1 0 3 32 1 0 6 33 1 0 7 34 1 0 10 35 1 6 12 36 1 1 13 37 1 0 13 38 1 0 14 39 1 0 15 40 1 6 16 41 1 0 17 42 1 1 18 43 1 0 19 44 1 1 20 45 1 0 21 46 1 0 22 47 1 0 25 48 1 0 27 49 1 0 28 50 1 0 30 51 1 0 M END