5288636 -OEChem-10051721123D 31 30 0 1 0 0 0 0 0999 V2000 -2.4679 0.8818 -0.5895 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2621 -1.1301 1.7338 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2257 -1.0154 0.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2447 -1.8199 -1.6417 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4046 -1.0195 0.3425 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1828 1.4398 0.4439 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6598 1.8030 0.1912 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.1284 -0.2003 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9234 1.8758 -1.3155 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 3.1267 0.8474 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7531 -0.0885 0.0546 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1155 -1.9111 -0.4202 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7636 -3.0460 0.3333 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8908 0.7750 -0.4795 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 1.4137 1.5274 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4414 2.2637 0.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2998 1.0197 0.6155 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1492 0.1482 -1.2878 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8565 0.8937 -1.7905 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9357 2.2476 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2191 2.5508 -1.8134 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8871 3.0853 1.9286 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 3.9595 0.4452 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 3.3453 0.6808 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -0.7099 2.0313 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2736 -3.7119 -0.3683 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0029 -3.6180 0.8717 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4964 -2.6492 1.0412 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2348 -0.1668 -0.9175 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3377 1.6041 -1.0345 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1959 0.8489 0.5686 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 14 1 0 0 0 0 2 5 1 0 0 0 0 2 25 1 0 0 0 0 3 11 2 0 0 0 0 4 12 2 0 0 0 0 5 8 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 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 10 1 0 0 0 0 7 17 1 0 0 0 0 8 11 1 0 0 0 0 8 18 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 M END > DB07989 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/OVUHENJPIUQHLJ-MRVPVSSYSA-N/SDF?record_type=3d > [H][C@](CC(C)C)(N(O)C(C)=O)C(=O)OC > InChI=1S/C9H17NO4/c1-6(2)5-8(9(12)14-4)10(13)7(3)11/h6,8,13H,5H2,1-4H3/t8-/m1/s1 > OVUHENJPIUQHLJ-MRVPVSSYSA-N > C9H17NO4 > 203.2356 > 203.115758037 > 3 > 31 > -0.1730268991534586 > 21.103378467898487 > 1 > 1 > 0 > 1 > methyl (2R)-2-(N-hydroxyacetamido)-4-methylpentanoate > 0.48 > 0.6369577733333339 > -1.08 > 0 > 0 > 0 > 0 > 7.6793777586001335 > -6.000840168388303 > 66.84 > 50.1484 > 5 > 1 > 1.70e+01 g/l > tetrahydrofolic acid > 0 $$$$