HMDB0035916 RDKit 3D (E)-2-Nonen-4-one 26 25 0 0 0 0 0 0 0 0999 V2000 3.3872 0.6151 0.8697 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5703 1.2859 -0.1579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5587 0.6878 -0.7478 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2103 -0.6787 -0.3981 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8791 -1.2784 0.4726 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0777 -1.3286 -1.0758 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9308 -1.8704 -0.0711 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4767 -0.7323 0.7823 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1638 0.3029 -0.1049 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7054 1.4456 0.7338 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2004 1.3398 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 0.3461 1.7947 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9679 -0.2558 0.4539 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7751 2.3220 -0.4745 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9845 1.2493 -1.5092 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4428 -0.7074 -1.7945 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4693 -2.2363 -1.6207 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7789 -2.2714 -0.6478 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5162 -2.6807 0.5576 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2695 -1.1785 1.4113 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6375 -0.2965 1.3257 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 0.7458 -0.8295 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9989 -0.1434 -0.6699 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9753 1.7781 1.5017 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6824 1.2043 1.2043 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9105 2.3357 0.0878 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 3 15 1 0 6 16 1 0 6 17 1 0 7 18 1 0 7 19 1 0 8 20 1 0 8 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 10 26 1 0 M END