HMDB0060506 RDKit 3D S-(2,2-Dichloro-1-hydroxy)ethyl glutathione 44 43 0 0 0 0 0 0 0 0999 V2000 4.3239 0.9909 -0.2313 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2573 -0.4500 -0.4329 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8505 -0.8819 -0.0599 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8946 -0.1261 -0.9931 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.5413 -0.6355 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2172 -1.8776 -0.7446 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3174 0.3076 -0.2661 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6526 0.3554 0.1417 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8997 -0.3263 1.4455 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5376 -2.0885 1.4589 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7552 -2.9717 0.4757 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7087 -2.6623 -0.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5856 -4.4799 0.6569 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -5.3103 -0.3340 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9512 -4.8917 0.0989 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 1.7895 0.2382 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4138 2.0205 0.6174 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3166 2.7459 -0.0175 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7109 4.1246 0.0637 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9047 4.9132 1.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0323 4.4053 1.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1796 6.2471 1.1842 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5514 -0.7691 -1.8354 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 0.1064 -2.6811 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5424 -2.0929 -2.2396 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 1.2097 0.5822 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3234 1.2645 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9922 -0.8967 0.2686 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6555 -0.6264 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7853 -1.9711 -0.2531 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1626 -0.4217 -2.0221 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 0.9630 -0.8633 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2921 -2.3253 -1.6467 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -0.1547 -0.6241 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3754 0.1687 2.2966 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9947 -0.2002 1.6931 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7898 -2.7194 0.8447 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5029 -2.9952 -1.3225 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7719 -4.7293 1.7049 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7317 2.1961 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7684 4.1629 0.4173 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6495 4.5646 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9227 6.6169 1.7281 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7012 -2.6432 -2.1509 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 5 7 2 3 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 1 0 8 16 1 0 16 17 1 0 16 18 2 3 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 2 23 1 0 23 24 2 0 23 25 1 0 1 26 1 0 1 27 1 0 2 28 1 1 3 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 6 33 1 0 8 34 1 6 9 35 1 0 9 36 1 0 11 37 1 0 12 38 1 0 13 39 1 0 17 40 1 0 19 41 1 0 19 42 1 0 22 43 1 0 25 44 1 0 M END