HMDB0062174 RDKit 3D Methionine sulfone 22 21 0 0 0 0 0 0 0 0999 V2000 -3.6276 -0.7646 -0.2284 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2766 0.2303 0.3385 S 0 0 0 0 0 6 0 0 0 0 0 0 -2.4736 1.6543 -0.0679 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2522 0.1717 1.8322 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7314 -0.3266 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3709 0.5484 0.1922 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 0.0984 -0.3552 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9658 -1.2590 0.0684 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8047 1.0029 0.1078 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7399 2.2247 -0.1833 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8629 0.5215 0.8456 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6125 -1.7409 0.2858 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5642 -0.2540 0.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6216 -0.9144 -1.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5588 -1.3693 0.0339 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7501 -0.3594 -1.4106 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3913 0.5528 1.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2396 1.5937 -0.1334 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6322 0.1079 -1.4646 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9704 -1.3605 0.3827 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3189 -1.5072 0.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 1.1493 1.3498 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 2 0 2 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 2 0 9 11 1 0 1 12 1 0 1 13 1 0 1 14 1 0 5 15 1 0 5 16 1 0 6 17 1 0 6 18 1 0 7 19 1 6 8 20 1 0 8 21 1 0 11 22 1 0 M END