0 B23R3.242641 COc1ccc(C2=COc3cc(O)cc(C)c3C2=O)cc1 Amb19816055 [0,0,0,0,0,0|1,0,0]=1 1 B23R3.242641 COc1ccc(C2=COc3cc(O)cc(O)c3C2=O)cc1 Amb18012239 [0,0,0,0,0,0|0,0,0]=0 2 B22R3.302562 COc1ccc(C2=COc3cc(O)ccc3C2=O)cc1 Amb18001466 [1,0,0,0,0,0|0,0,0]=1 3 B22R3.5327493 O=C1C(c2ccc(Cl)cc2)=COc3cc(O)cc(O)c31 Amb18010287 [1,0,0,0,0,0|1,0,0]=2 4 B22R3.5327493 O=C1C(c2ccc(O)cc2)=COc3cc(O)cc(O)c31 Amb17933801 [1,0,0,0,0,0|0,0,0]=1 5 B22R3.5327493 O=C1c2c(O)cc(O)cc2OCC1c3ccc(O)cc3 Amb6298030 [1,0,0,0,0,0|0,0,2]=3 6 B24R3.2565808 COc1ccc(C2=C(C)Oc3cc(O)cc(O)c3C2=O)cc1 Amb19543898 [0,1,0,0,0,0|0,0,0]=1 7 B24R3.2574564 COc1ccc(C2=COc3cc(OC)cc(O)c3C2=O)cc1 Amb18511673 [0,1,0,0,0,0|0,0,0]=1 8 B21R2.125542 COc1ccc(CC(=O)c2c(O)cc(O)cc2O)cc1 Amb546802 [1,0,1,0,0,0|0,0,1]=3 9 B21R3.3759272 Nc1ccc(C2=COc3cc(O)ccc3C2=O)cc1 Amb18529732 [2,0,0,0,0,0|1,0,0]=3 10 B21R3.3759272 O=C1C(c2ccc(Br)cc2)=COc3cc(O)ccc31 Amb17988994 [2,0,0,0,0,0|1,0,0]=3 11 B21R3.3759272 O=C1C(c2ccc(Cl)cc2)=COc3cc(O)ccc31 Amb17988983 [2,0,0,0,0,0|1,0,0]=3 12 B21R3.3759272 O=C1C(c2ccc(F)cc2)=COc3cc(O)ccc31 Amb17989219 [2,0,0,0,0,0|1,0,0]=3 13 B21R3.3759272 O=C1C(c2ccc(O)cc2)=COc3cc(O)ccc31 Amb17933362 [2,0,0,0,0,0|0,0,0]=2 14 B21R3.3759272 O=C1c2ccc(O)cc2OCC1c3ccc(O)cc3 Amb6296265 [2,0,0,0,0,0|0,0,2]=4 15 B21R3.29513194 Cc1cc(O)cc2c1C(=O)C(c3ccccc3)=CO2 Amb20621416 [2,0,0,0,0,0|1,0,0]=3 16 B21R3.29513194 O=C1C(c2ccccc2)=COc3cc(O)cc(O)c31 Amb18048930 [2,0,0,0,0,0|0,0,0]=2 17 B23R2.5649975 COc1ccc(CC(=O)c2c(O)cc(OC)cc2OC)cc1 Amb2715558 [0,1,1,0,0,0|0,0,2]=4 18 B23R3.237896 COc1ccc(C2=C(C)Oc3cc(O)ccc3C2=O)cc1 Amb18012756 [1,1,0,0,0,0|0,0,0]=2 19 B23R3.237896 COc1ccc(C2=C(C)c3ccc(O)cc3OC2=O)cc1 Amb19804487 [1,1,0,0,0,0|1,0,0]=3 20 B23R3.237896 COc1ccc(C2=C(O)c3ccc(O)cc3OC2=O)cc1 Amb19514367 [1,1,0,0,0,0|0,0,1]=3 21 B23R3.242546 COc1ccc(C2=COc3cc(OC)ccc3C2=O)cc1 Amb18511674 [1,1,0,0,0,0|0,0,0]=2 22 B23R3.242546 COc1ccc(C2COc3cc(OC)ccc3C2=O)cc1 Amb6297979 [1,1,0,0,0,0|0,0,2]=4 23 B23R3.245247 COc1ccc(C2=COc3c(ccc(O)c3C)C2=O)cc1 Amb19952201 [1,1,0,0,0,0|0,0,0]=2 24 B23R3.17104249 O=C1C(c2ccc([N+](=O)[O-])cc2)=COc3cc(O)ccc31 Amb18363634 [1,1,0,0,0,0|2,0,0]=4 25 B23R3.39740563 COc1ccc(C2=COc3cc(O)ccc3C2=O)cc1O Amb19886309 [1,1,0,0,0,0|0,0,0]=2 26 B23R3.233723995 COc1ccc(-c2coc3cc(O)ccc3c2=O)c(O)c1 Amb6296239 [1,1,0,0,0,0|0,0,0]=2 27 B23R3.29719259 COc1cc(O)cc2c1C(=O)C(c3ccc(O)cc3)=CO2 Amb19742205 [1,1,0,0,0,0|0,0,0]=2 28 B23R3.142662276 O=C1C(c2ccc(O)cc2O)=COc3cc(O)cc(O)c31 Amb19928275 [1,1,0,0,0,0|0,0,0]=2 29 B23R3.142662276 O=C1c2c(O)cc(O)cc2OCC1c3ccc(O)cc3O Amb6297969 [1,1,0,0,0,0|0,0,2]=4 30 B23R3.199772359 COc1cc(O)c2c(c1)OC=C(c3ccc(O)cc3)C2=O Amb18511596 [1,1,0,0,0,0|0,0,0]=2 31 B25R3.69007046 COc1ccc(C2=COc3cc(O)cc(O)c3C2=O)cc1OC Amb19543927 [0,2,0,0,0,0|0,0,0]=2 32 B25R3.367476831 COc1ccc(C2COc3cc(O)cc(O)c3C2=O)c(OC)c1 Amb22172849 [0,2,0,0,0,0|0,0,2]=4 33 B23R3.240097 COc1ccc(\C=C2/Oc3cc(C)cc(O)c3C2=O)cc1 Amb5789688 [0,0,1,1,0,0|1,0,0]=3 34 B23R3.240097 COc1ccc(\C=C2/Oc3cc(O)cc(C)c3C2=O)cc1 Amb563052 [0,0,1,1,0,0|1,0,0]=3 35 B23R3.9101252 CCc1ccc(OC2=COc3cc(O)ccc3C2=O)cc1 Amb17997801 [1,0,0,0,0,1|1,0,0]=3 36 B23R3.9101252 COc1ccc(OC2=COc3cc(O)ccc3C2=O)cc1 Amb17989047 [1,0,0,0,0,1|0,0,0]=2 37 B23R3.9068341 COc1ccc(C2=CC(=O)c3c(O)cc(O)cc3O2)cc1 Amb18511409 [0,0,0,0,1,1|0,0,0]=2