HMDB0060980 RDKit 3D N-desmethylrosiglitazone 41 43 0 0 0 0 0 0 0 0999 V2000 -7.6580 -1.6429 -1.0335 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7838 -1.2443 -0.2376 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7777 -1.2139 1.1536 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -0.9873 1.7771 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6137 -0.9344 3.2104 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4887 -0.7536 0.9971 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7703 0.4883 1.4528 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5462 0.6523 0.6251 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3327 0.1040 0.9793 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2022 0.2811 0.1725 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2501 0.9967 -0.9891 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7587 1.2473 -1.8662 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0801 0.8921 -1.9102 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3805 -0.5849 -1.9979 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8139 -0.7818 -2.0333 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6763 -0.5884 -0.9206 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1677 -0.2598 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0136 -0.0554 1.3875 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3784 -0.1935 1.1837 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8596 -0.5239 -0.0585 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0121 -0.7104 -1.0639 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4936 1.5428 -1.3254 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6118 1.3797 -0.5468 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1876 -0.5543 -0.6696 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1724 -0.2957 3.7382 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8388 -1.6437 0.9645 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4674 1.3366 1.3416 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4836 0.3406 2.5047 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2384 -0.4715 1.8872 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7335 -0.1501 0.4796 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6308 1.4076 -1.1174 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4961 1.3170 -2.8814 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9705 -0.9608 -2.9825 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8948 -1.1953 -1.2323 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2346 -1.0924 -2.9671 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -0.1552 0.5183 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6059 0.2026 2.3482 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0574 -0.0378 2.0143 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9463 -0.6248 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6087 2.1215 -2.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 1.7995 -0.8002 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 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 11 22 1 0 22 23 2 0 6 24 1 0 24 2 1 0 23 8 1 0 21 16 1 0 5 25 1 0 6 26 1 0 7 27 1 0 7 28 1 0 9 29 1 0 10 30 1 0 13 31 1 0 13 32 1 0 14 33 1 0 14 34 1 0 15 35 1 0 17 36 1 0 18 37 1 0 19 38 1 0 20 39 1 0 22 40 1 0 23 41 1 0 M END