HMDB0029415 RDKit 3D S-Carboxymethyl-L-cysteine 20 19 0 0 0 0 0 0 0 0999 V2000 1.5200 -1.8404 -0.2281 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8004 -0.5671 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6501 0.3452 0.0799 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9417 -0.3447 0.6306 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 0.8105 0.0711 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 0.3764 0.4458 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1069 0.7932 1.5065 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2557 -0.5087 -0.3957 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0187 0.0142 -0.1627 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6088 -0.5625 -1.1368 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5665 1.1982 0.2876 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4828 -1.9672 -0.2992 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0007 -2.6370 0.2384 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9044 -0.6750 1.5321 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6073 0.4273 -1.0204 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7979 1.3159 0.5645 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9726 1.8091 0.5376 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1068 0.8961 -1.0444 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8839 -0.7146 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1101 1.8311 0.9182 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 2 9 1 0 9 10 2 0 9 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 3 15 1 0 3 16 1 0 5 17 1 0 5 18 1 0 8 19 1 0 11 20 1 0 M END