HMDB0302180 RDKit 3D Allyl-1-propenyl trisulfide 19 18 0 0 0 0 0 0 0 0999 V2000 4.2310 1.1018 -0.0622 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1489 -0.2077 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9214 -0.9565 0.1271 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5596 0.0857 0.6709 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0825 -1.2096 1.0484 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1783 -1.3578 -0.7674 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4027 -0.0538 -0.7186 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5106 -0.2915 -0.0281 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5671 0.7520 0.0513 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3827 1.7157 0.2727 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1423 1.6408 -0.2913 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0096 -0.7558 -0.5107 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1676 -1.6350 0.9949 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6536 -1.5749 -0.7543 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2771 0.8958 -1.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7023 -1.2185 0.4954 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3444 1.4092 0.9387 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 0.2843 0.2051 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5955 1.3760 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 1 10 1 0 1 11 1 0 2 12 1 0 3 13 1 0 3 14 1 0 7 15 1 0 8 16 1 0 9 17 1 0 9 18 1 0 9 19 1 0 M END