HMDB0037295 RDKit 3D 3-[(2-Mercapto-1-methylpropyl)thio]-2-butanol 29 28 0 0 0 0 0 0 0 0999 V2000 -3.2514 0.2674 1.0966 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -0.9145 0.4562 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3928 -1.8863 1.4285 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3182 -0.5825 -0.2745 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5915 0.4029 -1.3565 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0046 -0.1468 0.8422 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5377 0.2178 -0.0245 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4129 1.4633 -0.8239 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6951 0.2362 0.9466 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8233 -1.1270 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2632 0.6204 0.1948 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7027 0.9687 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5797 0.7798 1.8186 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 -0.1412 1.6818 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2921 -1.3445 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1958 -2.3815 1.6722 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0153 -1.5472 -0.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8713 1.3967 -0.9562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7512 0.4165 -2.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4563 0.0018 -1.9611 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7803 -0.6266 -0.7358 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4299 1.9315 -0.6073 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1579 2.2453 -0.5463 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 1.2119 -1.9051 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4408 0.9525 1.7526 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6341 -1.0280 2.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8778 -1.4939 2.0309 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2212 -1.8174 0.8268 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3815 1.9245 -0.2694 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 9 11 1 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 3 16 1 0 4 17 1 0 5 18 1 0 5 19 1 0 5 20 1 0 7 21 1 0 8 22 1 0 8 23 1 0 8 24 1 0 9 25 1 0 10 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 M END