HMDB0061657 RDKit 3D 3-hydroxypentadecanoic acid 48 47 0 0 0 0 0 0 0 0999 V2000 6.8927 1.5058 0.3309 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8196 0.0032 0.4493 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7060 -0.5798 -0.3657 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -0.0352 0.0729 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2717 -0.6499 -0.7588 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9457 -0.0527 -0.2685 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8227 -0.6296 -1.0545 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5088 -0.0271 -0.6016 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7932 -0.2815 0.8403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0727 0.2629 1.3065 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3725 -0.2597 0.8538 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7014 -0.2876 -0.5877 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1372 -0.7542 -0.8381 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2676 -2.0352 -0.3143 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1731 0.1777 -0.3222 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1193 1.5227 -0.8852 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0705 2.2014 -0.8043 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2250 2.0622 -1.5141 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7281 1.8212 1.0276 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9638 2.0051 0.6932 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 1.7853 -0.7031 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6987 -0.2905 1.5094 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7798 -0.3899 0.0415 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8387 -0.3149 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7096 -1.6701 -0.2164 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1917 -0.1678 1.1572 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3146 1.0715 -0.1184 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3933 -0.4197 -1.8301 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2051 -1.7449 -0.6316 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9863 1.0500 -0.3745 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8596 -0.3426 0.8038 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7203 -1.7239 -0.9295 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -0.4471 -2.1214 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2314 -0.3328 -1.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3591 1.0975 -0.7771 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0585 0.2254 1.4106 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -1.3576 1.1095 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0676 0.2168 2.4603 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1141 1.3984 1.0882 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6304 -1.2475 1.3526 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1546 0.4419 1.3203 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1258 -1.1928 -1.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4376 0.5694 -1.1894 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2144 -0.8715 -1.9421 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7547 -2.6390 -0.9165 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1681 -0.3196 -0.5216 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 0.1646 0.8127 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9953 1.4816 -1.8747 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 13 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 10 38 1 0 10 39 1 0 11 40 1 0 11 41 1 0 12 42 1 0 12 43 1 0 13 44 1 0 14 45 1 0 15 46 1 0 15 47 1 0 18 48 1 0 M END