784625 -OEChem-10051720053D 22 23 0 0 0 0 0 0 0999 V2000 -1.3717 -2.4654 0.6086 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9714 0.2591 0.3555 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5341 0.0288 0.0173 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3285 0.6732 1.8334 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3099 0.1348 -0.2461 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0775 -0.0353 -0.6183 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7058 -0.4370 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0537 -0.9029 0.3159 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9022 1.3788 -0.4642 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2011 0.0409 -0.1799 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0917 -0.3885 -1.4821 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3897 -0.6964 0.6599 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2383 1.5850 -0.1202 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 0.5474 0.4417 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3373 0.2775 0.6437 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2357 -0.7303 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 2.1996 -0.9009 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9029 -0.6377 -2.1515 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -1.4940 1.0988 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6996 2.5534 -0.2899 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0222 0.7082 0.7095 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2954 0.2011 0.6118 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 2 6 1 0 0 0 0 2 10 1 0 0 0 0 3 15 1 0 0 0 0 3 22 1 0 0 0 0 4 15 2 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 7 11 1 0 0 0 0 7 16 1 0 0 0 0 8 12 2 0 0 0 0 9 13 1 0 0 0 0 9 17 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 18 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 M END > DB02909 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/PJGGWIHXGHQXMM-UHFFFAOYSA-N/SDF?record_type=3d > OC(=O)C1=CC=C(O1)C1=CC=CC=C1Cl > InChI=1S/C11H7ClO3/c12-8-4-2-1-3-7(8)9-5-6-10(15-9)11(13)14/h1-6H,(H,13,14) > PJGGWIHXGHQXMM-UHFFFAOYSA-N > C11H7ClO3 > 222.624 > 222.008371797 > 2 > 22 > -0.9998643397319427 > 21.132133891054316 > 1 > 1 > 0 > 1 > 5-(2-chlorophenyl)furan-2-carboxylic acid > 3.50 > 2.8623465299999995 > -3.54 > 0 > -1 > 2 > -1 > 3.132515596311416 > -3.111946557610192 > 50.440000000000005 > 55.523600000000016 > 2 > 1 > 6.40e-02 g/l > tetrahydrofolic acid > 0 $$$$