HMDB0035883 RDKit 3D 2'-Hydroxyisoorientin 53 56 0 0 0 0 0 0 0 0999 V2000 1.1189 -0.1853 -2.8953 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5793 -0.0114 -1.7452 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9411 0.0368 -1.5555 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5059 0.2290 -0.3099 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9655 0.2588 -0.2552 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7657 1.3354 -0.0765 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1602 1.2094 0.0234 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0096 2.2702 0.2078 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7340 -0.0458 -0.0623 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1094 -0.2620 0.0225 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9545 -1.1563 -0.2426 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6130 -1.0080 -0.3374 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7877 -2.0907 -0.5154 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6932 0.3618 0.6884 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3811 0.3243 0.6061 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5868 0.4523 1.7363 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7867 0.3974 1.6662 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5974 0.5183 2.8262 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 0.2165 0.4494 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8692 0.0257 0.3154 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5736 -0.2436 1.4301 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8364 -0.7390 1.1399 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9030 -2.0672 0.4736 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2866 -2.3395 0.2901 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6176 0.2433 0.2901 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8791 -0.2670 0.0533 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9013 0.4678 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5972 1.4725 -1.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4954 0.8724 -0.7528 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4938 2.2405 -0.2648 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6205 0.0869 -0.7102 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1801 -0.0929 -1.9266 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7726 0.1399 -0.6165 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5731 -0.1004 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3374 2.3309 -0.0205 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8041 3.2314 0.2983 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5085 -1.1999 -0.0685 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4011 -2.1331 -0.3037 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1644 -3.0056 -0.5579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0827 0.5957 2.6779 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1692 0.6528 3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8601 -1.0386 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3742 -0.8278 2.1061 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5139 -2.9209 1.0478 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4797 -2.1036 -0.5571 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7918 -2.3297 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7338 1.1600 0.8936 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2671 0.2058 -0.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9295 -0.4313 -1.6222 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4497 2.3542 -1.2752 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9254 0.8701 -1.6734 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 2.2461 0.5856 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9981 -0.2069 -2.8427 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 1 0 7 9 2 0 9 10 1 0 9 11 1 0 11 12 2 0 12 13 1 0 4 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 22 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 19 31 1 0 31 32 1 0 31 33 2 0 33 2 1 0 12 5 1 0 33 15 1 0 29 20 1 0 3 34 1 0 6 35 1 0 8 36 1 0 10 37 1 0 11 38 1 0 13 39 1 0 16 40 1 0 18 41 1 0 20 42 1 0 22 43 1 0 23 44 1 0 23 45 1 0 24 46 1 0 25 47 1 0 26 48 1 0 27 49 1 0 28 50 1 0 29 51 1 0 30 52 1 0 32 53 1 0 M END