HMDB0035462 RDKit 3D Myricetin 3-(6-acetylgalactoside) 59 62 0 0 0 0 0 0 0 0999 V2000 4.9928 -3.8232 1.5213 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1472 -2.5727 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9217 -2.6863 1.7088 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7012 -1.3365 1.3616 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0226 -0.1333 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0075 0.1012 0.2983 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9891 -0.7967 0.2834 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9638 -0.3756 -0.6096 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2651 -0.9402 -0.2154 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1903 -0.2686 0.5579 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2037 0.4114 -0.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5307 0.5602 -1.4152 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4579 1.5516 -1.8007 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8475 1.7221 -3.0975 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7674 2.7295 -3.3774 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3498 0.9260 -4.1036 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7201 1.0691 -5.4295 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4454 -0.0446 -3.7368 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8634 -0.9203 -4.6561 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0443 -0.2214 -2.4039 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0263 1.0392 0.8476 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 1.0084 2.1445 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7425 1.6654 2.9968 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6174 1.6530 4.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5193 2.3368 5.1984 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5999 0.9674 4.9608 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7187 0.2989 4.1325 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6731 -0.4093 4.6777 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 0.3120 2.7585 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9768 -0.3453 1.9367 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0205 -0.9917 2.4253 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4706 -0.5979 -1.9552 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7993 -1.9340 -2.2352 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7228 0.2215 -2.1879 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.4883 -2.6072 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6722 0.2854 -1.0362 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6899 -0.6348 -1.2428 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6185 -4.5438 0.8019 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 -4.2621 2.5407 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0475 -3.5490 1.3488 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8307 0.6593 1.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6414 0.1512 2.3802 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5211 1.0950 0.5913 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8936 0.7244 -0.3999 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8791 2.2054 -1.0497 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1543 3.3290 -2.6772 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3676 1.7463 -5.7805 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1487 -0.7991 -5.6226 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3573 -1.0070 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5912 2.2413 2.5959 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3288 1.7973 5.4958 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4857 0.9457 6.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4927 -0.4799 5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7884 -0.3068 -2.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7561 -2.5191 -1.4501 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -0.2379 -3.0967 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8203 1.3512 -3.4734 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1403 1.2885 -1.0255 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5287 -1.1449 -2.0574 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 2 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 2 0 11 21 1 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 1 0 24 26 2 0 26 27 1 0 27 28 1 0 27 29 2 0 29 30 1 0 30 31 2 0 8 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 6 1 0 30 10 1 0 20 12 1 0 29 22 1 0 1 38 1 0 1 39 1 0 1 40 1 0 5 41 1 0 5 42 1 0 6 43 1 0 8 44 1 0 13 45 1 0 15 46 1 0 17 47 1 0 19 48 1 0 20 49 1 0 23 50 1 0 25 51 1 0 26 52 1 0 28 53 1 0 32 54 1 0 33 55 1 0 34 56 1 0 35 57 1 0 36 58 1 0 37 59 1 0 M END