HMDB0000017 RDKit 3D 4-Pyridoxic acid 22 22 0 0 0 0 0 0 0 0999 V2000 -2.9433 -1.5479 -0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5806 -1.0265 -0.3221 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5359 -1.9363 -0.5908 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -1.5162 -0.5007 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1591 -0.2666 -0.1537 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5464 0.0186 0.2568 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5496 -0.1083 -0.6829 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1464 0.6499 0.1115 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4044 2.0424 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8214 2.1590 0.3198 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0267 3.2566 0.3276 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1911 0.2117 0.0162 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1791 1.1948 0.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8405 -2.6238 0.2948 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6211 -1.6165 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3652 -1.0368 0.8056 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5676 -2.2094 -0.7487 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7878 -1.1982 0.7391 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8009 0.4345 1.2048 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3513 0.3404 -0.2357 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4392 3.7899 -0.4941 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1404 0.9886 0.2048 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 5 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 8 12 2 0 12 13 1 0 12 2 1 0 1 14 1 0 1 15 1 0 1 16 1 0 4 17 1 0 6 18 1 0 6 19 1 0 7 20 1 0 11 21 1 0 13 22 1 0 M END