HMDB0032401 RDKit 3D (+/-)-3-[(2-methyl-3-furyl)thio]-2-butanone 24 24 0 0 0 0 0 0 0 0999 V2000 3.7919 -0.4641 -0.7708 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4479 0.0809 -1.0995 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3453 0.5982 -2.1984 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2778 0.0476 -0.2394 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4166 0.7498 1.0721 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1837 0.5712 -1.1672 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6522 0.5554 -0.1801 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1513 1.5871 0.5737 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 1.1462 1.1918 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5106 -0.1010 0.8122 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5314 -0.4850 -0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4984 -1.8519 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5815 0.1528 -1.2517 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9187 -1.4920 -1.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0079 -0.4484 0.3133 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0924 -1.0405 0.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0366 1.6455 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3839 1.0760 1.3712 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7717 0.0591 1.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7738 2.5861 0.7214 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9777 1.6802 1.8468 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9829 -1.8913 -1.5875 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0321 -2.5748 0.0673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4502 -2.1870 -0.6544 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 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 11 7 2 0 1 13 1 0 1 14 1 0 1 15 1 0 4 16 1 0 5 17 1 0 5 18 1 0 5 19 1 0 8 20 1 0 9 21 1 0 12 22 1 0 12 23 1 0 12 24 1 0 M END