HMDB0244584 RDKit 3D 14-hydroxy-4,14-retro-retinol 52 52 0 0 0 0 0 0 0 0999 V2000 0.6538 -0.1407 1.9455 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5231 -0.2183 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7831 -0.1904 -0.2633 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -0.1843 0.1168 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0026 -0.1427 -1.0387 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2760 -0.1323 -0.7792 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7649 -0.1616 0.6086 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2794 -0.0682 -1.9039 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1031 -1.1707 -1.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5069 -0.0311 -3.2223 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4007 0.0213 -4.2625 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5771 -0.1666 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9076 -0.0111 0.2398 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0839 0.1262 0.6145 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3791 0.2423 2.0734 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4313 1.0067 2.9287 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4752 -0.2732 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4713 -0.9884 1.7852 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2525 -0.9449 0.3206 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3648 0.1346 -0.1997 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9742 1.5151 -0.1308 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1039 -0.1251 -1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6336 0.8904 2.3512 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1113 -0.7407 2.4692 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6214 -0.6409 2.2492 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6055 -0.1734 -1.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4186 -0.0998 1.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6053 -0.1176 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3594 0.6657 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 -1.1784 1.0182 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8939 -0.1452 0.6423 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7812 0.9049 -1.7944 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9144 -1.7187 -1.0648 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9118 0.9021 -3.1844 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8716 -0.9347 -3.3379 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6362 0.9721 -4.4043 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3753 -0.2963 -1.3004 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2915 0.2676 -1.0722 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1476 0.5270 3.8555 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0498 1.9273 3.2233 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6051 1.4306 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6924 -0.1896 3.6703 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4972 -0.5755 2.0057 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4488 -2.0500 2.1212 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7898 -1.9180 -0.0226 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2493 -0.8325 -0.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3575 2.2185 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9549 1.4839 -0.6329 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0123 1.9568 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7968 0.7737 -2.2121 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -1.0324 -1.8643 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1339 -0.3737 -2.0885 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 3 4 5 1 0 5 6 2 3 6 7 1 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 2 12 2 3 12 13 1 0 13 14 2 3 14 15 1 0 15 16 1 0 15 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 20 14 1 0 1 23 1 0 1 24 1 0 1 25 1 0 3 26 1 0 4 27 1 0 5 28 1 0 7 29 1 0 7 30 1 0 7 31 1 0 8 32 1 0 9 33 1 0 10 34 1 0 10 35 1 0 11 36 1 0 12 37 1 0 13 38 1 0 16 39 1 0 16 40 1 0 16 41 1 0 17 42 1 0 18 43 1 0 18 44 1 0 19 45 1 0 19 46 1 0 21 47 1 0 21 48 1 0 21 49 1 0 22 50 1 0 22 51 1 0 22 52 1 0 M END