HMDB0032093 RDKit 3D 4-Hydroxy-3-(16-methylheptadecyl)-2H-pyran-2-one 66 66 0 0 0 0 0 0 0 0999 V2000 -7.7327 -1.2948 -2.5351 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4602 -0.6193 -1.1524 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5099 0.8573 -1.4758 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1047 -1.0477 -0.7472 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6721 -0.5555 0.5834 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5665 0.9041 0.7987 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0783 1.1270 2.2556 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7387 0.4900 2.4846 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7372 1.0930 1.5412 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3503 0.4796 1.7352 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4481 1.1458 0.7652 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9735 0.5978 0.9143 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0769 -0.8462 0.6612 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4043 -1.4488 0.8551 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6022 -1.0617 0.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1897 0.2744 0.2199 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4220 0.3787 -0.6947 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4492 -0.6290 -0.2965 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6179 -0.4244 -1.1818 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4818 0.6027 -0.9461 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3870 1.5011 0.0818 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5770 0.7858 -1.8101 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6843 -0.1147 -2.8485 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8457 -1.0974 -3.0616 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8168 -1.2598 -2.2403 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0478 -2.2246 -2.5018 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4151 -0.6730 -3.1283 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1219 -2.2914 -2.3205 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7645 -1.4051 -3.0538 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2276 -0.9407 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1876 1.4284 -0.8025 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5016 1.2387 -1.5631 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0085 1.0105 -2.4927 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0824 -2.1906 -0.7818 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3484 -0.7248 -1.5187 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3224 -1.0061 1.4115 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6777 -1.0745 0.7883 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8929 1.4273 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5485 1.4043 0.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 0.6449 2.9003 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 2.2040 2.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7404 -0.6094 2.4988 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4252 0.8203 3.5136 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9764 0.9164 0.4726 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 2.1840 1.7301 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9701 0.6217 2.7642 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3985 -0.6110 1.5317 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3753 2.2322 1.0617 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 1.1327 -0.2719 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5228 1.1624 0.1216 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2904 0.8349 1.9424 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6797 -1.1317 -0.3597 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4067 -1.3555 1.4383 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2635 -2.5858 0.8406 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6865 -1.2973 1.9676 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4156 -1.7903 0.4832 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5453 -1.3832 -0.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6109 1.1528 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5273 0.4355 1.2849 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8484 1.3944 -0.6362 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0879 0.2591 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6887 -0.5086 0.7673 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0459 -1.6632 -0.4355 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7181 1.5642 0.8061 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2767 1.5828 -1.6557 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5062 -0.0228 -3.5441 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 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 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 20 22 1 0 22 23 2 0 23 24 1 0 24 25 1 0 25 26 2 0 25 19 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 3 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 4 35 1 0 5 36 1 0 5 37 1 0 6 38 1 0 6 39 1 0 7 40 1 0 7 41 1 0 8 42 1 0 8 43 1 0 9 44 1 0 9 45 1 0 10 46 1 0 10 47 1 0 11 48 1 0 11 49 1 0 12 50 1 0 12 51 1 0 13 52 1 0 13 53 1 0 14 54 1 0 14 55 1 0 15 56 1 0 15 57 1 0 16 58 1 0 16 59 1 0 17 60 1 0 17 61 1 0 18 62 1 0 18 63 1 0 21 64 1 0 22 65 1 0 23 66 1 0 M END