0 B15R1.10256 C=CC(=O)CC(=O)c1ccc(cc1O)O 1458a_100000185746_100009814262 [0,0,1,0,0,0|1,0,2]=4 1 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100000748629 [1,0,1,0,0,0|1,0,1]=4 2 B14R1.6048 C=C(F)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100009893438 [1,0,1,0,0,0|1,0,1]=4 3 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1O)O 1458a_100000070787_100009814262 [1,0,1,0,0,0|1,0,1]=4 4 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100000187820 [1,0,1,0,0,0|1,0,1]=4 5 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1O)O 1458a_100000212172_100020667443 [1,0,1,0,0,0|0,0,2]=4 6 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)O 1458a_100000212172_100102629194 [1,0,1,0,0,0|1,0,1]=4 7 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000070051 [1,0,1,0,0,0|1,0,1]=4 8 B14R2.8038 O=c1c(c[nH]c2c1cccc2F)O 271570a_203496583355_100012351745 [2,0,0,0,0,0|2,0,0]=4 9 B14R2.8045 O=c1cc[nH]c2c1cc(cc2F)O 271570a_203496583355_100000749450 [2,0,0,0,0,0|2,0,0]=4 10 B14R2.4513 Cc1ccc2occ(c(=O)c2c1)O 271570a_203496583355_200010005421 [2,0,0,0,0,0|2,0,0]=4 11 B14R2.4513 Cn1ccc2ccc(cc2c1=O)O 271570a_203496583355_100010371002 [2,0,0,0,0,0|2,0,0]=4 12 B14R2.4513 O=c1c(c[nH]c2c1cc(cc2)Br)O 271570a_203496583355_100012348040 [2,0,0,0,0,0|2,0,0]=4 13 B14R2.4513 O=c1c(coc2c1cc(cc2)Cl)O 271570a_203496583355_200010204847 [2,0,0,0,0,0|2,0,0]=4 14 B14R2.4513 O=c1c(coc2c1cc(cc2)F)O 271570a_203496583355_200009813772 [2,0,0,0,0,0|2,0,0]=4 15 B14R2.29365 Cc1cc2cc(ccc2c(=O)[nH]1)O 271570a_203496583355_100010883700 [2,0,0,0,0,0|2,0,0]=4 16 B14R2.29365 O=c1cc(c2ccc(cc2o1)O)O 271570a_203496583355_100010062223 [2,0,0,0,0,0|1,0,1]=4 17 B16R1.11441 CC(=O)C(=O)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100011261029 [0,1,1,0,0,0|0,0,2]=4 18 B16R2.36854 CC1=CC(=O)c2c(cccc2C1=O)O[13CH3] 7a_100000032304_200025704644 [1,1,0,0,0,0|1,0,0]=3 19 B16R2.36854 COc1cccc2c1C(=O)C=C(C2=O)C 7a_100000032304_200000210301 [1,1,0,0,0,0|1,0,0]=3 20 B16R2.95959 Oc1cc(cc(c1)c2ccccc2O)O 271570a_100000035170_100009868816 [0,0,1,1,0,0|2,0,0]=4 21 B16R2.95959 Oc1cc(cc(c1)c2ccccc2O)O 271570a_100010660742_100000739446 [0,0,1,1,0,0|2,0,0]=4 22 B16R2.95959 Oc1cc(cc(c1)c2ncccc2O)O 271570a_100010660742_100000034122 [0,0,1,1,0,0|2,0,0]=4 23 B16R2.2335 Cc1cc(ccc1c2coc(c2)C=O)O 271570a_100000040639_100000747035 [0,0,1,1,0,0|2,0,0]=4 24 B16R2.2335 Cc1cc(ccc1c2coc(c2)C=O)O 271570a_100000068347_100000729255 [0,0,1,1,0,0|2,0,0]=4 25 B16R2.2335 Cc1ccc(c(c1)O)c2coc(c2)C=O 271570a_100000068347_100012002257 [0,0,1,1,0,0|2,0,0]=4 26 B16R2.2335 Nc1cc(ccc1c2coc(c2)C=O)O 271570a_100000068347_100011999798 [0,0,1,1,0,0|2,0,0]=4 27 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2Br)O 271570a_100000068347_100000701344 [0,0,1,1,0,0|2,0,0]=4 28 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2Cl)O 271570a_100000068347_100000047559 [0,0,1,1,0,0|2,0,0]=4 29 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2Cl)O 271570a_100000079644_100000747035 [0,0,1,1,0,0|2,0,0]=4 30 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2F)O 271570a_100000068347_100000755031 [0,0,1,1,0,0|2,0,0]=4 31 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2F)O 271570a_100009854227_100000747035 [0,0,1,1,0,0|2,0,0]=4 32 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2O)Br 271570a_100000068347_100012344904 [0,0,1,1,0,0|2,0,0]=4 33 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2O)Cl 271570a_100000068347_100000050036 [0,0,1,1,0,0|2,0,0]=4 34 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2O)Cl 271570a_100010081499_100000747035 [0,0,1,1,0,0|2,0,0]=4 35 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2O)F 271570a_100000068347_100000690578 [0,0,1,1,0,0|2,0,0]=4 36 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2O)F 271570a_100010081493_100000747035 [0,0,1,1,0,0|2,0,0]=4 37 B16R2.2335 O=Cc1cc(co1)c2ccc(cc2O)O 271570a_100000068347_100009813921 [0,0,1,1,0,0|1,0,0]=3 38 B16R2.2335 O=Cc1cc(cs1)c2ccc(cc2O)O 271570a_100000067010_100009813921 [0,0,1,1,0,0|1,1,0]=4 39 B16R2.2335 O=Cc1coc(c1)c2ccc(cc2O)O 271570a_200000066965_100009813921 [0,0,1,1,0,0|1,0,1]=4 40 B16R2.2908 Oc1cccc(c1)c2ccc(cc2O)O 271570a_100000693801_100009813921 [0,0,1,1,0,0|2,0,0]=4 41 B16R2.2908 Oc1cncc(c1)c2ccc(cc2O)O 271570a_100010248756_100009813921 [0,0,1,1,0,0|2,0,0]=4 42 B14R2.8716 CN1C(=O)c2ccc(cc2C1=O)O 271570a_203496583355_200009814873 [1,0,0,0,1,0|2,0,0]=4