HMDB0031521 RDKit 3D Ethyl 2-mercaptopropionate 18 17 0 0 0 0 0 0 0 0999 V2000 2.4794 0.4174 0.6621 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0314 -0.1012 -0.6721 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7098 0.1526 -0.9913 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2979 -0.3352 -0.1859 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0718 -0.9954 0.8103 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7345 -0.1056 -0.4616 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5324 -0.7843 0.6261 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0445 1.6769 -0.3640 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6083 0.4692 0.6082 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1656 -0.2186 1.5009 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1762 1.4931 0.8109 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2054 -1.1994 -0.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6707 0.4168 -1.4432 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0074 -0.5023 -1.4673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9554 -0.6288 1.5823 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4976 -0.2807 0.6974 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6004 -1.8554 0.3763 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4486 2.3810 -1.4155 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 2 0 4 6 1 0 6 7 1 0 6 8 1 0 1 9 1 0 1 10 1 0 1 11 1 0 2 12 1 0 2 13 1 0 6 14 1 0 7 15 1 0 7 16 1 0 7 17 1 0 8 18 1 0 M END