34359 -OEChem-05161812523D 30 30 0 1 0 0 0 0 0999 V2000 -1.2387 1.1316 1.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4324 2.0075 -0.1335 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0852 1.9880 -0.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -0.2057 0.7057 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3349 -0.5390 -0.7861 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3376 -0.2742 0.1887 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0251 -0.3993 -0.1321 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9186 -0.6959 -1.1731 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5016 -0.5612 -0.6703 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -1.4089 1.0263 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9378 1.0285 0.4142 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1415 0.6621 -0.7716 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1316 -1.6644 -0.1202 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4514 0.7862 -0.3085 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4414 -1.5403 0.3429 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1013 -0.3151 0.2488 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0526 -1.7073 -1.5833 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.0236 -2.0359 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2018 -2.4288 0.6708 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7341 -1.1836 1.8178 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0394 -1.4279 1.5354 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 0.1206 -1.5587 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6395 1.5223 -1.2065 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6289 -2.6244 -0.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9363 -2.4066 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4478 0.7325 0.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -0.6045 -0.1669 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1928 2.0584 1.8921 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9808 1.8920 -0.0372 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6655 -1.0665 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 28 1 0 0 0 0 2 11 2 0 0 0 0 3 14 1 0 0 0 0 3 29 1 0 0 0 0 4 16 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 13 15 2 0 0 0 0 13 24 1 0 0 0 0 14 16 2 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 M END > DB00190 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/TZFNLOMSOLWIDK-JTQLQIEISA-N/SDF?record_type=3d > C[C@@](CC1=CC(O)=C(O)C=C1)(NN)C(O)=O > InChI=1S/C10H14N2O4/c1-10(12-11,9(15)16)5-6-2-3-7(13)8(14)4-6/h2-4,12-14H,5,11H2,1H3,(H,15,16)/t10-/m0/s1 > TZFNLOMSOLWIDK-JTQLQIEISA-N > C10H14N2O4 > 226.2292 > 226.095356946 > 6 > 30 > 21.806808336346297 > 1 > 5 > 0 > 0 > (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid > -0.16 > -1.2078362008406989 > -1.78 > 0 > 1 > -1 > 9.28650563164388 > 2.3544595300449216 > 5.663329899668677 > 115.80999999999999 > 68.7683 > 4 > 1 > 3.73e+00 g/l > carbidopa > 0 $$$$