HMDB0029806 RDKit 3D Methyl nicotinate 17 17 0 0 0 0 0 0 0 0999 V2000 3.1736 -0.8731 0.2504 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8184 -0.4652 0.3384 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9764 -0.3571 -0.7313 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4124 -0.6330 -1.8787 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4299 0.0778 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8733 0.3707 0.7119 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 0.7754 0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0099 0.8823 -0.1657 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5584 0.5907 -1.3999 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2851 0.1919 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8074 -0.2623 0.9278 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5283 -0.8330 -0.8077 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3077 -1.9317 0.5668 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2141 0.2869 1.5558 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5277 1.0128 1.9343 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0219 1.2053 0.0417 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9386 -0.0382 -2.5982 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 5 1 0 1 11 1 0 1 12 1 0 1 13 1 0 6 14 1 0 7 15 1 0 8 16 1 0 10 17 1 0 M END