HMDB0037141 RDKit 3D 4-[(2-Methyl-3-furanyl)thio]-5-nonanone 39 39 0 0 0 0 0 0 0 0999 V2000 -4.6085 1.9046 0.3264 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1677 1.6929 0.7055 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5823 0.4564 0.0719 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 0.3871 0.5564 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4807 -0.8081 -0.0302 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1508 -1.4788 -0.7939 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9016 -1.2322 0.2483 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2139 -2.5211 -0.4725 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3775 -3.6869 -0.0877 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8091 -4.9209 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0363 0.0150 -0.3483 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1186 1.4921 0.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5551 1.8582 1.8074 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 3.1500 2.0559 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7164 3.5372 1.0643 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8508 2.6067 0.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 2.6890 -1.0913 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1702 0.9458 0.2316 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7253 2.4878 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0889 2.4986 1.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5761 2.5708 0.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1324 1.5645 1.8067 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5781 0.5166 -1.0267 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1038 -0.4495 0.4439 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1594 0.3984 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6541 1.3121 0.1264 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0378 -1.4159 1.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2874 -2.8191 -0.2853 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1296 -2.3884 -1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5608 -3.9981 0.9863 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6939 -3.5743 -0.1883 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9032 -4.9201 -1.0659 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5513 -5.8569 -0.3511 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2688 -4.8886 -1.8528 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9336 1.2057 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6673 3.7070 2.9439 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5986 2.1414 -0.9306 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7761 3.7219 -1.4276 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0984 2.0993 -1.8853 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 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 7 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 16 12 2 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 4 26 1 0 7 27 1 0 8 28 1 0 8 29 1 0 9 30 1 0 9 31 1 0 10 32 1 0 10 33 1 0 10 34 1 0 13 35 1 0 14 36 1 0 17 37 1 0 17 38 1 0 17 39 1 0 M END