8193 -OEChem-02092015333D 39 38 0 0 0 0 0 0 0999 V2000 -7.5285 0.3835 -0.0391 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0326 0.4287 0.0054 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2648 -0.3869 0.0172 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2936 -0.4382 0.0354 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5652 0.4227 0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5903 0.3775 0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8252 -0.4451 0.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8521 -0.4891 0.0162 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1227 0.3694 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1167 0.3748 -0.0373 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3830 -0.4932 -0.0788 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3888 -0.4636 -0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6418 0.3596 -0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 1.0638 -0.8887 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0393 1.1013 0.8718 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2847 -1.0198 -0.8792 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2432 -1.0699 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2803 -1.0648 0.9357 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2814 -1.1190 -0.8246 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5738 1.0229 0.9959 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5804 1.1283 -0.7616 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6078 1.0490 0.8782 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5939 1.0141 -0.8827 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7869 -1.0823 -0.8651 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8364 -1.1160 0.8949 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8663 -1.1091 0.9205 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8356 -1.1690 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1007 1.0524 -0.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1663 0.9951 0.8993 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 1.0776 0.8052 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1137 0.9942 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3759 -1.0776 -1.0059 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3973 -1.2052 0.7545 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4302 -1.1331 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4322 -1.0655 0.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6925 0.9291 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5316 -0.2750 -0.0869 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6714 1.0657 -0.8635 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3124 -0.1916 -0.0182 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 5 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 M END > DB06894 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/LQZZUXJYWNFBMV-UHFFFAOYSA-N/SDF?record_type=3d > CCCCCCCCCCCCO > InChI=1S/C12H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h13H,2-12H2,1H3 > LQZZUXJYWNFBMV-UHFFFAOYSA-N > C12H26O > 186.3342 > 186.198365454 > 1 > 39 > 8.747455040604531e-10 > 25.859642681042505 > 1 > 1 > 0 > 1 > dodecan-1-ol > 5.36 > 4.3618712660000005 > -4.86 > 0 > 0 > 0 > 0 > 16.84394282199214 > -1.9922594096606376 > 20.23 > 58.9429 > 10 > 1 > 2.60e-03 g/l > mozenavir > 1 $$$$