HMDB0112188 RDKit 3D 10-Hydroxyhexadecanoic acid 51 50 0 0 0 0 0 0 0 0999 V2000 -6.9549 -0.0138 -0.4258 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7273 0.8293 -0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0604 0.3389 1.1088 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8273 1.1326 1.4452 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8086 1.0572 0.3562 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3476 -0.3816 0.0841 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3308 -0.2609 -1.0293 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0148 0.3212 -2.1122 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6806 -1.5496 -1.4163 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0411 -2.1463 -0.2441 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1011 -1.2360 0.2872 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1565 -0.8937 -0.7146 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2309 0.0315 -0.1842 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9558 -0.5791 0.9848 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0238 0.3155 1.5355 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 0.6414 0.5158 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1268 1.5220 1.1266 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9882 1.8490 2.3251 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2027 1.9539 0.3832 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6154 -0.9194 -0.9711 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 0.5935 -1.0744 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4583 -0.3224 0.5179 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0435 0.7002 -1.0219 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0233 1.8990 -0.0486 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8109 0.4490 1.9442 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8162 -0.7288 0.9985 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4031 0.8434 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1607 2.2074 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8908 1.6199 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1839 1.4306 -0.6137 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8071 -0.7753 0.9866 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2011 -1.0218 -0.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5746 0.4769 -0.7005 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4417 0.9466 -2.6201 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4084 -2.2887 -1.8272 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0395 -1.3395 -2.2367 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5579 -3.0905 -0.5568 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7023 -2.3986 0.5495 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6586 -0.2986 0.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5997 -1.7586 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7312 -0.4420 -1.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6436 -1.8461 -1.0485 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0037 0.2073 -0.9894 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 0.9985 0.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -1.5104 0.6085 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2414 -0.8138 1.8044 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5855 1.2885 1.9077 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5129 -0.1490 2.4293 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 -0.2995 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6243 1.1695 -0.3594 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1197 2.2415 -0.5881 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 7 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 2 0 17 19 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 3 25 1 0 3 26 1 0 4 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 6 31 1 0 6 32 1 0 7 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 10 37 1 0 10 38 1 0 11 39 1 0 11 40 1 0 12 41 1 0 12 42 1 0 13 43 1 0 13 44 1 0 14 45 1 0 14 46 1 0 15 47 1 0 15 48 1 0 16 49 1 0 16 50 1 0 19 51 1 0 M END