HMDB0035672 RDKit 3D 5-Hydroxy-7-eicosanone 62 61 0 0 0 0 0 0 0 0999 V2000 -8.6733 1.7306 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4344 0.9322 0.6225 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9415 0.1292 -0.5423 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7171 -0.6717 -0.1317 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5774 0.1892 0.3321 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4231 -0.6861 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9773 -1.5097 -0.4531 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8228 -2.3506 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5923 -1.7705 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2179 -0.7992 -0.3244 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3928 0.5055 -0.6429 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4881 1.4011 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7078 1.8839 -0.8051 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7683 0.9853 -0.3612 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0812 0.9113 0.8481 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5322 0.1208 -1.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6084 -0.6288 -0.5631 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0729 -1.4190 0.4394 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7058 0.2303 -0.0139 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7187 -0.6589 0.6797 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8593 0.1681 1.2522 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5375 0.9070 0.1115 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3606 2.5455 -0.4589 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1330 2.2008 1.1006 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4062 1.0597 -0.2846 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6632 1.6869 0.8893 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6666 0.2780 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6790 0.7670 -1.4042 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 -0.6065 -0.8959 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9521 -1.3900 0.6786 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4576 -1.2735 -1.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2063 0.8693 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9189 0.7481 1.2302 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7353 -1.3304 1.5819 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6157 -0.0444 1.1197 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9697 -1.0031 -1.4111 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8261 -2.3081 -0.6421 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5378 -2.9982 -0.9755 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1983 -3.0916 0.6955 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0815 -2.6490 0.7638 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7619 -1.2939 1.4949 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6044 -1.2990 -1.2822 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1539 -0.6470 0.2504 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4205 0.4720 -1.0781 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5853 1.0014 0.3856 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7036 0.8149 -2.3999 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1772 2.2595 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 2.5603 0.0979 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1393 2.6811 -1.5218 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8315 -0.6672 -1.6866 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9423 0.7017 -2.1517 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0711 -1.3809 -1.3022 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2188 -1.0272 1.3298 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1775 0.7717 -0.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3213 0.9557 0.6948 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2080 -1.1735 1.5107 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1005 -1.3865 -0.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4976 0.8740 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6263 -0.4787 1.7184 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5051 1.3256 0.4231 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6687 0.1555 -0.7024 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8847 1.7202 -0.2724 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 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 4 31 1 0 5 32 1 0 5 33 1 0 6 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 9 40 1 0 9 41 1 0 10 42 1 0 10 43 1 0 11 44 1 0 11 45 1 0 12 46 1 0 12 47 1 0 13 48 1 0 13 49 1 0 16 50 1 0 16 51 1 0 17 52 1 0 18 53 1 0 19 54 1 0 19 55 1 0 20 56 1 0 20 57 1 0 21 58 1 0 21 59 1 0 22 60 1 0 22 61 1 0 22 62 1 0 M END