HMDB0302499 RDKit 3D 3-Methylidene-4-oxopentyl angelate 30 29 0 0 0 0 0 0 0 0999 V2000 2.8055 0.9820 -1.3064 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5623 0.2740 -0.2355 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 0.0739 0.2147 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1979 0.7584 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1381 0.5716 -0.2676 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7299 -0.6636 -0.1808 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0334 -1.6848 -0.5133 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0969 -0.8600 0.2669 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6774 -2.2491 0.3356 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 0.1821 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3208 1.5667 0.5688 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6918 -0.3116 0.5016 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0784 -0.0915 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5284 -0.9963 1.5293 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0077 1.4210 -1.8642 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8348 1.1143 -1.6164 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0587 0.5804 1.2161 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9532 -0.9969 0.3812 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4413 1.8510 -0.7143 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3455 0.3496 -1.7285 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4203 -2.7078 1.2919 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -2.1890 0.2642 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3553 -2.8585 -0.5356 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8604 -0.0058 0.9478 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0187 1.9063 -0.4531 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4479 1.7541 1.2303 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1702 2.2542 0.8309 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0855 -0.3991 -1.0645 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3005 1.0142 0.0574 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8186 -0.6398 0.6065 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 2 0 6 8 1 0 8 9 1 0 8 10 2 0 10 11 1 0 2 12 1 0 12 13 1 0 12 14 2 0 1 15 1 0 1 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 9 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 11 25 1 0 11 26 1 0 11 27 1 0 13 28 1 0 13 29 1 0 13 30 1 0 M END