33791 -OEChem-10051720133D 16 17 0 0 0 0 0 0 0999 V2000 1.5532 2.9425 -0.0024 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7268 -2.9130 -0.0017 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.5595 0.4692 0.0026 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4079 -2.4624 0.0001 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6641 1.1757 0.0015 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1155 -1.0797 -0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3845 1.0828 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8769 -0.2063 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5022 2.0433 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 1.3124 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0568 -1.3192 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3302 -0.1532 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8362 0.2078 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3212 -1.0999 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5301 2.6606 0.9019 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5312 2.6589 -0.9031 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 2 11 1 0 0 0 0 3 13 1 0 0 0 0 4 14 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 6 12 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 10 13 2 0 0 0 0 11 14 2 0 0 0 0 13 14 1 0 0 0 0 M END > DB03302 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/NMWKWBPNKPGATC-UHFFFAOYSA-N/SDF?record_type=3d > ClC1=C2COC(=O)C2=C(Cl)C(Cl)=C1Cl > InChI=1S/C8H2Cl4O2/c9-4-2-1-14-8(13)3(2)5(10)7(12)6(4)11/h1H2 > NMWKWBPNKPGATC-UHFFFAOYSA-N > C8H2Cl4O2 > 271.912 > 269.880890136 > 1 > 16 > -3.618156513147452e-06 > 21.650682798531115 > 1 > 0 > 0 > 0 > 4,5,6,7-tetrachloro-1,3-dihydro-2-benzofuran-1-one > 4.15 > 3.944128786666667 > -4.73 > 0 > 0 > 2 > 0 > 12.441511079138985 > -7.000756786988578 > 26.3 > 55.85710000000001 > 0 > 1 > 5.02e-03 g/l > tetrahydrofolic acid > 1 $$$$