HMDB0032160 RDKit 3D 3-(Acetylthio)-2-methylfuran 18 18 0 0 0 0 0 0 0 0999 V2000 3.4210 0.2272 0.0473 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9931 -0.0787 0.3363 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6149 -0.2490 1.4854 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8616 -0.1857 -1.0612 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7641 -0.5578 -0.4481 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2817 -1.8308 -0.2626 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5658 -1.6118 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7662 -0.3287 0.3127 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7293 0.3601 -0.0746 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5597 1.8395 -0.1265 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5487 0.7473 -0.9121 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0285 -0.6906 0.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7864 0.9154 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7704 -2.7439 -0.4641 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2334 -2.4290 0.4722 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6376 2.1671 0.3953 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4518 2.3193 0.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4942 2.1301 -1.2113 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 9 5 2 0 1 11 1 0 1 12 1 0 1 13 1 0 6 14 1 0 7 15 1 0 10 16 1 0 10 17 1 0 10 18 1 0 M END