HMDB0255441 RDKit 3D [(2R,3S,4R,5R)-5-(3-Carboxypyridin-1-ium-1-yl)-3,4-dihydroxy-tetrahydrofuran-... 36 37 0 0 0 0 0 0 0 0999 V2000 -6.3054 0.3434 -1.6285 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 0.8026 -1.4054 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8556 2.1346 -1.6603 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0823 -0.0299 -0.8711 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3647 -1.3635 -0.6104 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3314 -2.1258 -0.1062 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0846 -1.5742 0.1219 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8186 -0.2817 -0.1330 N 0 0 0 0 0 4 0 0 0 0 0 0 -0.5011 0.2792 0.1139 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4243 -0.1221 -0.8567 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6202 0.3541 -0.2721 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8252 -0.0969 -1.0536 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9504 0.3956 -0.4381 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3835 -0.0272 -1.2002 P 0 0 0 0 0 5 0 0 0 0 0 0 5.9450 -1.2389 -0.4909 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1371 -0.3958 -2.8389 O 0 0 0 0 0 1 0 0 0 0 0 0 6.5111 1.2516 -1.1519 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5522 -0.2934 1.0941 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3676 0.3577 2.0168 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0733 -0.1260 1.4354 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0182 0.9472 2.3539 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8218 0.4665 -0.6246 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2659 2.6709 -1.0071 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3576 -1.7516 -0.8053 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5573 -3.1722 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2997 -2.2062 0.5184 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5291 1.3865 0.0882 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 1.4584 -0.2243 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7207 0.1623 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8486 -1.2235 -1.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1027 2.0158 -0.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8423 -1.3423 1.0213 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0915 0.0503 2.9126 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3652 -1.0145 1.8838 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2312 1.7914 1.8597 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5868 1.5178 -0.8264 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 14 17 1 0 11 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 8 22 2 0 22 4 1 0 20 9 1 0 3 23 1 0 5 24 1 0 6 25 1 0 7 26 1 0 9 27 1 0 11 28 1 0 12 29 1 0 12 30 1 0 17 31 1 0 18 32 1 0 19 33 1 0 20 34 1 0 21 35 1 0 22 36 1 0 M CHG 2 8 1 16 -1 M END