8280 -OEChem-10051719193D 22 22 0 1 0 0 0 0 0999 V2000 -0.0913 1.2664 0.4908 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4794 -2.1614 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1337 1.6017 0.1331 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1496 -0.4916 -0.0749 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0021 0.1542 0.4526 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0531 0.4072 -0.6176 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -1.0042 0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -0.0415 1.8337 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1715 0.8471 0.1744 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4188 0.7025 -1.9655 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 -1.2804 -0.4468 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6676 1.2715 -0.3372 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7231 -0.4553 -0.7133 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1487 0.8559 2.1535 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2967 -0.8925 1.8544 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8276 -0.2214 2.5825 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 1.5963 -1.9379 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8228 -0.1368 -2.3363 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2051 0.8884 -2.7055 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0534 -1.9045 -1.3083 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5591 -1.9370 0.3914 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1596 -0.6376 -0.6814 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 9 1 0 0 0 0 2 7 2 0 0 0 0 3 9 2 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 M END > DB00617 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/VQASKUSHBVDKGU-UHFFFAOYSA-N/SDF?record_type=3d > CCC1(C)OC(=O)N(C)C1=O > InChI=1S/C7H11NO3/c1-4-7(2)5(9)8(3)6(10)11-7/h4H2,1-3H3 > VQASKUSHBVDKGU-UHFFFAOYSA-N > C7H11NO3 > 157.1671 > 157.073893223 > 2 > 22 > 0.0 > 15.386610378286832 > 1 > 0 > 0 > 0 > 5-ethyl-3,5-dimethyl-1,3-oxazolidine-2,4-dione > 0.90 > 1.0266687253333333 > -0.07 > 0 > 0 > 1 > 0 > 46.61000000000001 > 37.7242 > 1 > 1 > 1.35e+02 g/l > biotin > 0 $$$$