HMDB0000656 RDKit 3D Cysteineglutathione disulfide 49 48 0 0 0 0 0 0 0 0999 V2000 5.8449 1.5462 1.8647 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2297 0.2616 1.8483 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7788 0.3483 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8207 1.4274 1.1651 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6897 0.6000 -0.7858 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -0.4600 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0252 0.3233 -0.8913 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1543 -0.6116 -1.0469 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1385 -0.7759 -0.0437 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -0.1137 1.0465 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2385 -1.7294 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2133 -1.8037 0.8669 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2732 -2.8308 0.4607 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9146 -2.3863 -0.7501 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2547 -2.9716 1.5616 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4609 -2.7164 1.3211 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8747 -3.3729 2.8323 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 1.3306 -1.9626 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9434 1.1514 -2.8812 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7778 2.4419 -2.0092 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6673 3.3913 -3.1155 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6559 4.4777 -2.9616 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4251 4.4684 -1.9679 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7727 5.5100 -3.8677 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -0.6246 2.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8814 -0.1509 3.4741 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5135 -1.9450 3.0198 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3735 2.2660 2.4239 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 1.4747 2.0249 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2649 -0.2400 0.8587 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3531 -0.6826 2.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6634 0.6325 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3323 -0.9884 -1.9529 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2842 -1.2125 -0.1467 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1056 0.7987 0.0875 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1932 -1.1486 -1.9334 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8649 -2.7671 -0.4511 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7683 -1.3953 -1.1929 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6949 -0.8350 1.0874 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6738 -2.1488 1.7632 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7876 -3.8105 0.2622 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8456 -1.3658 -0.8933 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5448 -2.9379 -1.5713 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9139 -3.6787 3.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4817 2.6418 -1.2853 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3676 3.8314 -3.1242 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8828 2.8292 -4.0507 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0281 6.1790 -3.9859 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6401 -2.2275 2.5952 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 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 7 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 2 25 1 0 25 26 2 0 25 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 3 31 1 0 3 32 1 0 6 33 1 0 6 34 1 0 7 35 1 1 8 36 1 0 11 37 1 0 11 38 1 0 12 39 1 0 12 40 1 0 13 41 1 6 14 42 1 0 14 43 1 0 17 44 1 0 20 45 1 0 21 46 1 0 21 47 1 0 24 48 1 0 27 49 1 0 M END