6464 -OEChem-10051719343D 29 29 0 0 0 0 0 0 0999 V2000 -0.6839 -1.4419 1.6648 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0842 1.0608 -2.2335 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5807 -0.7628 0.1131 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4517 -1.0184 0.9421 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8355 0.2323 -1.0048 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3885 0.3220 0.0272 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3609 1.6144 0.8627 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8272 0.0461 -0.4334 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0808 -0.8084 0.9377 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5001 0.5578 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7856 2.8038 0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2603 1.4727 2.0848 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9187 -1.2751 -1.1217 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3756 -0.5187 0.0322 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6834 -2.2846 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6592 1.8087 1.2216 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1881 0.7930 -1.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5429 0.0407 0.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7937 2.7149 -0.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7977 3.7063 0.6342 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0839 3.0248 -0.7987 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3249 1.3986 1.8509 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1657 2.3821 2.6933 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9764 0.6572 2.7527 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8092 -1.6687 1.6364 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4759 0.5039 -1.7456 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3505 -1.4179 -2.0371 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7177 -3.2191 -1.2404 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2839 -2.2026 0.2081 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 10 2 0 0 0 0 3 14 2 0 0 0 0 4 9 1 0 0 0 0 4 14 1 0 0 0 0 4 25 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 16 1 0 0 0 0 8 13 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 15 2 0 0 0 0 13 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 M END > DB01352 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/UORJNBVJVRLXMQ-UHFFFAOYSA-N/SDF?record_type=3d > CC(C)C1(CC=C)C(=O)NC(=O)NC1=O > InChI=1S/C10H14N2O3/c1-4-5-10(6(2)3)7(13)11-9(15)12-8(10)14/h4,6H,1,5H2,2-3H3,(H2,11,12,13,14,15) > UORJNBVJVRLXMQ-UHFFFAOYSA-N > C10H14N2O3 > 210.2298 > 210.100442324 > 3 > 29 > -0.24938816060297078 > 20.49806032119566 > 1 > 2 > 0 > 1 > 5-(prop-2-en-1-yl)-5-(propan-2-yl)-1,3-diazinane-2,4,6-trione > 1.24 > 1.144694595333333 > -1.61 > 0 > 0 > 1 > 0 > 11.14844819302882 > 7.478869260649751 > 75.27000000000001 > 53.446 > 3 > 1 > 5.17e+00 g/l > tetrahydrofolic acid > 0 $$$$