4786 -OEChem-09282114083D 24 24 0 1 0 0 0 0 0999 V2000 -1.4691 1.6349 1.0639 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1731 0.3817 -1.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2232 0.2388 0.8736 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2490 -0.3480 -0.1221 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2135 0.1069 0.4151 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0049 -1.8300 -0.4128 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9321 -1.0236 0.7626 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7767 1.1199 -0.3411 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2561 -1.1450 0.3406 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1006 0.9984 -0.7633 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8402 -0.1340 -0.4224 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3389 -0.2375 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2576 -0.2140 0.2862 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9642 -2.4059 0.5178 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -2.2393 -1.0144 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0798 -2.0069 -0.9713 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -1.8144 1.3606 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2248 2.0089 -0.6308 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3756 1.3676 -1.2326 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8938 0.0396 -2.0283 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3882 1.7297 1.3668 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8325 -2.0262 0.6068 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5552 1.7844 -1.3593 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8709 -0.2286 -0.7513 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 21 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 8 10 2 0 0 0 0 8 18 1 0 0 0 0 9 11 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 24 1 0 0 0 0 M END > DB00397 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/DLNKOYKMWOXYQA-UHFFFAOYSA-N/SDF?record_type=3d > CC(N)C(O)C1=CC=CC=C1 > InChI=1S/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3 > DLNKOYKMWOXYQA-UHFFFAOYSA-N > C9H13NO > 151.209 > 151.099714043 > 2 > 24 > 0.9957535508704913 > 16.99546146613676 > 1 > 2 > 0 > 0 > 2-amino-1-phenylpropan-1-ol > 0.57 > 0.8852543346666666 > -0.87 > 0 > 1 > 1 > 1 > 13.896164133633944 > 9.370138989147625 > 46.25 > 44.9127 > 2 > 1 > 2.06e+01 g/l > 1,13-dimethyl-10-(3-methylbut-2-en-1-yl)-10-azatricyclo[7.3.1.0^{2,7}]trideca-2(7),3,5-trien-4-ol > 0 $$$$