243556 -OEChem-10051721143D 23 24 0 0 0 0 0 0 0999 V2000 2.9041 2.8718 -0.0005 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.9032 -2.8721 -0.0001 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.0567 -0.0004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0985 0.0001 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5455 0.0003 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5987 -1.2078 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5991 1.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2428 -0.0002 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2431 0.0005 1.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 1.2080 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9936 -1.2081 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6913 -0.0001 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6376 -0.0003 -1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 0.0002 1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3353 -0.0001 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0529 -2.1495 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0534 2.1499 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7145 -0.0005 -2.1585 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7151 0.0007 2.1589 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1806 -0.0005 -2.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1814 0.0003 2.1482 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4213 -0.0003 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3651 0.9223 0.0000 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 12 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 11 1 0 0 0 0 6 16 1 0 0 0 0 7 10 2 0 0 0 0 7 17 1 0 0 0 0 8 13 1 0 0 0 0 8 18 1 0 0 0 0 9 14 2 0 0 0 0 9 19 1 0 0 0 0 10 12 1 0 0 0 0 11 12 2 0 0 0 0 13 15 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 M END > DB08102 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/SKQRVOXIIAXXEM-UHFFFAOYSA-N/SDF?record_type=3d > OC1=C(Br)C=C(C=C1Br)C1=CC=CC=C1 > InChI=1S/C12H8Br2O/c13-10-6-9(7-11(14)12(10)15)8-4-2-1-3-5-8/h1-7,15H > SKQRVOXIIAXXEM-UHFFFAOYSA-N > C12H8Br2O > 327.999 > 325.894190172 > 1 > 23 > -0.6637186894715175 > 25.810008139581004 > 1 > 1 > 0 > 1 > 3,5-dibromo-[1,1'-biphenyl]-4-ol > 5.08 > 4.854411107000001 > -5.03 > 0 > -1 > 2 > -1 > 6.704718684253198 > -7.402058398250764 > 20.23 > 68.42070000000001 > 1 > 1 > 3.03e-03 g/l > tetrahydrofolic acid > 1 $$$$