HMDB0006794 RDKit 3D 5-(2'-Carboxyethyl)-4,6-Dihydroxypicolinate 25 25 0 0 0 0 0 0 0 0999 V2000 4.2978 2.1238 -0.5566 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4465 1.2042 -0.6304 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6512 0.2081 -1.5662 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2395 1.1862 0.2722 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -0.0081 -0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1547 -0.0987 0.8573 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7465 1.0276 0.7386 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4077 2.2327 0.9909 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0829 0.8530 0.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6242 -0.2622 0.0459 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0261 -0.3913 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 -1.4834 -0.6502 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7945 0.7730 -0.4731 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7897 -1.4494 0.1497 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5231 -1.3617 0.5214 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1877 -2.5876 0.5864 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4399 -0.4108 -1.4136 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6588 2.0948 -0.0544 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6092 1.2469 1.2913 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9923 -0.9209 0.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -0.0792 -1.0596 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -0.1506 1.9159 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4119 1.6909 -0.3209 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2621 -2.4040 -0.0934 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5046 -3.0332 -0.2449 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 10 14 1 0 14 15 2 0 15 16 1 0 15 6 1 0 3 17 1 0 4 18 1 0 4 19 1 0 5 20 1 0 5 21 1 0 6 22 1 0 13 23 1 0 14 24 1 0 16 25 1 0 M END