HMDB0031271 RDKit 3D 2-Nonenoic acid 27 26 0 0 0 0 0 0 0 0999 V2000 -2.9102 1.1995 0.1865 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1694 -0.2684 0.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0898 -1.1634 0.5294 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7765 -1.1152 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0634 0.1801 -0.1091 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3087 0.0912 -0.8002 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -0.8914 -0.1492 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3275 -0.5618 0.3859 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9303 0.7445 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0784 0.8488 1.0152 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4177 1.9124 -0.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 1.4460 0.9008 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 1.6871 -0.8162 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8406 1.7132 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -0.4921 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4476 -0.4987 -1.0215 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.2359 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9795 -1.0640 1.6613 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9384 -1.4548 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1009 -1.9199 0.2741 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1145 0.6299 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6182 0.8933 -0.7819 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6528 1.1139 -0.8806 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1223 -0.2426 -1.8801 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8843 -1.9531 -0.0909 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -1.4137 0.8547 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5567 2.8150 0.3527 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 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 5 21 1 0 5 22 1 0 6 23 1 0 6 24 1 0 7 25 1 0 8 26 1 0 11 27 1 0 M END