0 B24R1.10090256 Cc1c(cc(cc1O)C(=O)CCCCCCCCCCCCO)O 1458a_100000031928_100009813331 [0,0,0,0,0,0|3,0,0]=3 1 B24R1.10090256 Cc1c(cc(cc1O)C(=O)CCCCCCOCCCCCO)O 1458a_100000031928_200132310570 [0,0,0,0,0,0|4,0,0]=4 2 B24R1.10090256 O=C(CCCCCCCCCCCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009813331 [0,0,0,0,0,0|2,0,0]=2 3 B24R1.10090256 O=C(CCCCCCOCCCCCO)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200132310570 [0,0,0,0,0,0|4,0,0]=4 4 B24R1.10090256 O=C(CCCCCCOCCCCCO)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200132310570 [0,0,0,0,0,0|4,0,0]=4 5 B24R1.10090256 O=C(CCCCCCOCCCCCO)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_200132310570 [0,0,0,0,0,0|4,0,0]=4 6 B24R1.10090256 O=C(CCCCCCOCCCCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_200132310570 [0,0,0,0,0,0|3,0,0]=3 7 B23R1.65645 OCCCCCCCCCCCCSc1cc(c(c(c1)O)O)O 62a_100009813331_100010658518 [1,0,0,0,0,0|3,0,0]=4 8 B23R1.121218 CCCCCCCCCCCCNC(=O)c1cc(cc(c1)O)O 240690a_100000210451_100000690292 [1,0,0,0,0,0|1,0,0]=2 9 B23R1.121218 CCCCCCCCCCCCNC(=O)c1cc(cc(c1)O)O 527a_100000210451_100000690292 [1,0,0,0,0,0|1,0,0]=2 10 B23R1.121218 CCCCCCCCCCCNCC(=O)c1cc(cc(c1)O)O 2230a_200011215754_100010006762 [1,0,0,0,0,0|2,0,0]=3 11 B23R1.121218 CCCCCCCCCCCNCC(=O)c1cc(cc(c1)O)O 34a_200011215754_100010006762 [1,0,0,0,0,0|2,0,0]=3 12 B23R1.121218 CCCCCCCCCCCOCC(=O)c1cc(cc(c1)O)O 34a_100000210809_100010006762 [1,0,0,0,0,0|2,0,0]=3 13 B23R1.121218 NCCCCCCCCCCOCC(=O)c1cc(cc(c1)O)O 34a_100000066964_100010006762 [1,0,0,0,0,0|3,0,0]=4 14 B23R1.121218 O=C(CNCCCCCCCCCCO)c1cc(cc(c1)O)O 2230a_100000066964_100010006762 [1,0,0,0,0,0|3,0,0]=4 15 B23R1.121218 O=C(CNCCCCCCCCCCO)c1cc(cc(c1)O)O 34a_100000066964_100010006762 [1,0,0,0,0,0|3,0,0]=4 16 B23R1.121218 O=C(COCCCCCCCCCCBr)c1cc(cc(c1)O)O 34a_100009813290_100010006762 [1,0,0,0,0,0|3,0,0]=4 17 B23R1.121218 O=C(COCCCCCCCCCCCl)c1cc(cc(c1)O)O 34a_200000033068_100010006762 [1,0,0,0,0,0|3,0,0]=4 18 B23R1.121218 O=C(CSCCCCCCCCCCO)c1cc(cc(c1)O)O 62a_100009813290_100010006762 [1,0,0,0,0,0|3,0,0]=4 19 B23R1.121218 O=C(CSCCCCCCCCCCO)c1cc(cc(c1)O)O 62a_100010006762_200000033068 [1,0,0,0,0,0|3,0,0]=4 20 B23R1.121234 CCCCCCCCCCCOCC(=O)c1ccc(c(c1)O)O 7a_100000210809_100000183813 [1,0,0,0,0,0|2,0,0]=3 21 B23R1.121234 CCCCCCCCOCCCOC(=O)c1ccc(c(c1)F)F 34a_100035314219_100000210759 [1,0,0,0,0,0|3,0,0]=4 22 B23R1.121234 CCCCCCCCOCCCOC(=O)c1ccc(c(c1)F)F 7a_100035314219_100000210759 [1,0,0,0,0,0|3,0,0]=4 23 B23R1.121234 O=C(CCCCCCCCCCCCO)c1ccc(c(c1)O)O 1458a_100000212155_100009813331 [1,0,0,0,0,0|2,0,0]=3 24 B23R1.121234 O=C(CCCCCCOCCCCCO)c1ccc(c(c1)O)O 1458a_100000212155_200132310570 [1,0,0,0,0,0|3,0,0]=4 25 B23R1.121234 O=C(COCCCCCCCCCCBr)c1ccc(c(c1)O)O 7a_100009813290_100000183813 [1,0,0,0,0,0|3,0,0]=4 26 B23R1.121234 O=C(COCCCCCCCCCCCl)c1ccc(c(c1)O)O 7a_200000033068_100000183813 [1,0,0,0,0,0|3,0,0]=4 27 B23R1.121234 O=C(CSCCCCCCCCCCO)c1ccc(c(c1)O)O 62a_100009813290_100000183813 [1,0,0,0,0,0|3,0,0]=4 28 B23R1.708427 CCCCC#CCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000043322 [1,0,0,0,0,0|0,0,2]=3 29 B23R1.708427 CCCCCCCCCCCNC(=O)c1cc(c(c(c1)F)F)O 240690a_200011215754_200000081825 [1,0,0,0,0,0|3,0,0]=4 30 B23R1.708427 CCCCCCCCCCCNC(=O)c1cc(c(c(c1)F)O)F 240690a_200011215754_100000766045 [1,0,0,0,0,0|3,0,0]=4 31 B23R1.708427 CCCCCCCCCCCNC(=O)c1cc(c(c(c1)F)O)F 527a_200011215754_100000766045 [1,0,0,0,0,0|3,0,0]=4 32 B23R1.708427 CCCCCCCCCCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_200011215754_100000031928 [1,0,0,0,0,0|2,0,0]=3 33 B23R1.708427 CCCCCCCCCCCNC(=O)c1cc(c(c(c1)O)C)O 527a_200011215754_100000031928 [1,0,0,0,0,0|2,0,0]=3 34 B23R1.708427 Cc1c(cc(cc1O)C(=O)CCCCCCCCCCCO)O 1458a_100000031928_100009812471 [1,0,0,0,0,0|2,0,0]=3 35 B23R1.708427 Cc1c(cc(cc1O)C(=O)NCCCCCCCCCCO)O 240690a_100000066964_100000031928 [1,0,0,0,0,0|3,0,0]=4 36 B23R1.708427 O=C(CCCCCCCCCCCO)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100009812471 [1,0,0,0,0,0|2,0,0]=3 37 B23R1.708427 O=C(CCCCCCCCCCCO)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100009812471 [1,0,0,0,0,0|2,0,0]=3 38 B23R1.708427 O=C(CCCCCCCCCCCO)c1cc(c(c(c1)F)F)O 1458a_200000081825_100009812471 [1,0,0,0,0,0|3,0,0]=4 39 B23R1.708427 O=C(CCCCCCCCCCCO)c1cc(c(c(c1)F)O)F 1458a_100000766045_100009812471 [1,0,0,0,0,0|3,0,0]=4 40 B23R1.708427 O=C(CCCCCCCCCCCO)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100009812471 [1,0,0,0,0,0|2,0,0]=3 41 B23R1.708427 O=C(CCCCCCCCCCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009812471 [1,0,0,0,0,0|1,0,0]=2 42 B23R1.708427 O=C(NCCCCCCCCCCO)c1cc(c(c(c1)Br)O)O 240690a_100000066964_200009992764 [1,0,0,0,0,0|3,0,0]=4 43 B23R1.708427 O=C(NCCCCCCCCCCO)c1cc(c(c(c1)Cl)O)O 240690a_100000066964_200000078382 [1,0,0,0,0,0|3,0,0]=4 44 B23R1.708427 O=C(NCCCCCCCCCCO)c1cc(c(c(c1)O)Br)O 240690a_100000066964_100009812877 [1,0,0,0,0,0|3,0,0]=4 45 B23R1.708427 O=C(NCCCCCCCCCCO)c1cc(c(c(c1)O)Cl)O 240690a_100000066964_100000074654 [1,0,0,0,0,0|3,0,0]=4 46 B25R1.8713816 Cc1c(cc(cc1O)C(=O)NCCCCCCCCCCCCO)O 240690a_100000066677_100000031928 [0,1,0,0,0,0|2,0,0]=3 47 B25R1.8713816 Cc1cc(cc(c1O)C)C(=O)NCCCCCCCCCCCCO 240690a_100000066677_100011219978 [0,1,0,0,0,0|3,0,0]=4 48 B25R1.8713816 O=C(CCCCCCCCCCCCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009812470 [0,1,0,0,0,0|1,0,0]=2 49 B25R1.8713816 O=C(NCCCCCCCCCCCCO)c1cc(c(c(c1)Br)O)O 240690a_100000066677_200009992764 [0,1,0,0,0,0|2,0,0]=3 50 B25R1.8713816 O=C(NCCCCCCCCCCCCO)c1cc(c(c(c1)Cl)O)O 240690a_100000066677_200000078382 [0,1,0,0,0,0|2,0,0]=3 51 B25R1.8713816 O=C(NCCCCCCCCCCCCO)c1cc(c(c(c1)F)F)O 240690a_100000066677_200000081825 [0,1,0,0,0,0|3,0,0]=4 52 B25R1.8713816 O=C(NCCCCCCCCCCCCO)c1cc(c(c(c1)F)O)F 240690a_100000066677_100000766045 [0,1,0,0,0,0|3,0,0]=4 53 B25R1.8713816 O=C(NCCCCCCCCCCCCO)c1cc(c(c(c1)O)Br)O 240690a_100000066677_100009812877 [0,1,0,0,0,0|2,0,0]=3 54 B25R1.8713816 O=C(NCCCCCCCCCCCCO)c1cc(c(c(c1)O)Cl)O 240690a_100000066677_100000074654 [0,1,0,0,0,0|2,0,0]=3 55 B25R1.35398334 CCOC(=O)CCCCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009828014 [0,1,0,0,0,0|2,0,1]=4 56 B25R1.40391385 COC(=O)CCCCCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009812566 [0,1,0,0,0,0|2,0,1]=4 57 B25R1.49363078 CCCCCCCCCCOC(=O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210668 [0,1,0,0,0,0|2,0,1]=4 58 B25R1.61410049 COc1cc(cc(c1O)O)C(=O)CCCCCCCCCCCCO 1458a_100000061230_100009813331 [0,1,0,0,0,0|2,0,0]=3 59 B25R1.61410049 COc1cc(cc(c1O)O)C(=O)CCCCCCOCCCCCO 1458a_100000061230_200132310570 [0,1,0,0,0,0|3,0,0]=4 60 B25R1.61410050 COc1c(cc(cc1O)C(=O)CCCCCCCCCCCCO)O 1458a_100000073573_100009813331 [0,1,0,0,0,0|2,0,0]=3 61 B25R1.61410050 COc1c(cc(cc1O)C(=O)CCCCCCOCCCCCO)O 1458a_100000073573_200132310570 [0,1,0,0,0,0|3,0,0]=4 62 B25R2.10517633 O=C(CCCCCCOC1CCCCO1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100000033462 [0,0,0,1,0,0|3,0,0]=4 63 B25R2.141146615 CCCCCCCCCCc1noc(n1)c2cc(c(c(c2)O)O)O 270196a_200011216699_100000212154 [0,0,0,1,0,0|2,0,1]=4 64 B25R2.511165842 Cc1c(cc(cc1O)C(=O)NC2CCCCCCCCCCC2)O 240690a_100011194316_100000031928 [0,0,0,1,0,0|2,0,0]=3 65 B25R2.511165842 Cc1c(cc(cc1O)C(=O)NC2CCCCCCCCCCC2)O 527a_100011194316_100000031928 [0,0,0,1,0,0|2,0,0]=3 66 B25R2.618541191 O=C1CCCCCCCCCCC1C(=O)c2cc(c(c(c2)O)O)O 1458a_100000212154_200009990614 [0,0,0,1,0,0|2,0,1]=4 67 B22R1.39620 OCCCCCCCCCCCSc1cc(c(c(c1)O)O)O 62a_100009812471_100010658518 [2,0,0,0,0,0|1,1,0]=4 68 B22R1.2670 CCCCCCCCCCCNCC(=O)c1cccc(c1)O 34a_200011215754_100009813753 [2,0,0,0,0,0|2,0,0]=4 69 B22R1.2670 O=C(CCCCCCCCCCCCO)c1cccc(c1)O 1458a_100000183914_100009813331 [2,0,0,0,0,0|2,0,0]=4 70 B22R1.21631 CCCCCCCCCCCNC(=O)c1cc(cc(c1)F)O 11a_200011215754_100012017291 [2,0,0,0,0,0|2,0,0]=4 71 B22R1.21631 CCCCCCCCCCCNC(=O)c1cc(cc(c1)F)O 240690a_200011215754_100012017291 [2,0,0,0,0,0|2,0,0]=4 72 B22R1.21631 CCCCCCCCCCCNC(=O)c1cc(cc(c1)F)O 527a_200011215754_100012017291 [2,0,0,0,0,0|2,0,0]=4 73 B22R1.21631 CCCCCCCCCCCNC(=O)c1cc(cc(c1)O)C 240690a_200011215754_100000094094 [2,0,0,0,0,0|2,0,0]=4 74 B22R1.21631 CCCCCCCCCCCNC(=O)c1cc(cc(c1)O)C 527a_200011215754_100000094094 [2,0,0,0,0,0|2,0,0]=4 75 B22R1.21631 CCCCCCCCCCCNC(=O)c1cc(cc(c1)O)O 240690a_200011215754_100000690292 [2,0,0,0,0,0|1,0,0]=3 76 B22R1.21631 CCCCCCCCCCCNC(=O)c1cc(cc(c1)O)O 527a_200011215754_100000690292 [2,0,0,0,0,0|1,0,0]=3 77 B22R1.21631 CCCCCCCCCCNCC(=O)c1cc(cc(c1)O)O 2230a_100000684558_100010006762 [2,0,0,0,0,0|1,0,0]=3 78 B22R1.21631 CCCCCCCCCCNCC(=O)c1cc(cc(c1)O)O 34a_100000684558_100010006762 [2,0,0,0,0,0|1,0,0]=3 79 B22R1.21631 CCCCCCCCCCOCC(=O)c1cc(cc(c1)O)O 34a_100000210711_100010006762 [2,0,0,0,0,0|1,0,0]=3 80 B22R1.21631 Cc1cc(cc(c1)C(=O)CCCCCCCCCCCO)O 1458a_100000094094_100009812471 [2,0,0,0,0,0|2,0,0]=4 81 B22R1.21631 NCCCCCCCCCOCC(=O)c1cc(cc(c1)O)O 34a_100000078944_100010006762 [2,0,0,0,0,0|2,0,0]=4 82 B22R1.21631 O=C(CCCCCCCCCCCO)c1cc(cc(c1)F)O 1458a_100012017291_100009812471 [2,0,0,0,0,0|2,0,0]=4 83 B22R1.21631 O=C(CNCCCCCCCCCO)c1cc(cc(c1)O)O 2230a_100000078944_100010006762 [2,0,0,0,0,0|2,0,0]=4 84 B22R1.21631 O=C(CNCCCCCCCCCO)c1cc(cc(c1)O)O 34a_100000078944_100010006762 [2,0,0,0,0,0|2,0,0]=4 85 B22R1.21631 O=C(COCCCCCCCCCBr)c1cc(cc(c1)O)O 34a_100009813782_100010006762 [2,0,0,0,0,0|2,0,0]=4 86 B22R1.21631 O=C(COCCCCCCCCCCl)c1cc(cc(c1)O)O 34a_100009868337_100010006762 [2,0,0,0,0,0|2,0,0]=4 87 B22R1.21631 O=C(CSCCCCCCCCCO)c1cc(cc(c1)O)O 62a_100009813782_100010006762 [2,0,0,0,0,0|2,0,0]=4 88 B22R1.21631 O=C(CSCCCCCCCCCO)c1cc(cc(c1)O)O 62a_100010006762_100009813782 [2,0,0,0,0,0|2,0,0]=4 89 B22R1.21631 O=C(NCCCCCCCCCCO)c1cc(cc(c1)O)O 240690a_100000066964_100000690292 [2,0,0,0,0,0|2,0,0]=4 90 B22R1.2669 CCCCCCCCCCCNCC(=O)c1ccc(cc1)O 34a_200011215754_100009814261 [2,0,0,0,0,0|2,0,0]=4 91 B22R1.2669 CCCCCCCCCCNCCC(=O)c1ccc(cc1)O 2230a_100000684558_100009879949 [2,0,0,0,0,0|2,0,0]=4 92 B22R1.2669 CCCCCCCCCNCCCC(=O)c1ccc(cc1)O 2230a_100000212291_100000039620 [2,0,0,0,0,0|2,0,0]=4 93 B22R1.2669 CCCCCCCCCOCCOC(=O)c1ccc(cc1)C 7a_200000031072_100000210328 [2,0,0,0,0,0|2,0,0]=4 94 B22R1.2669 O=C(CCCCCCCCCCCCO)c1ccc(cc1)O 1458a_100000212099_100009813331 [2,0,0,0,0,0|2,0,0]=4 95 B22R1.21649 CCCCC#CCCCCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000043322 [2,0,0,0,0,0|0,0,2]=4 96 B22R1.21649 CCCCCCCCCCCNC(=O)c1ccc(c(c1)C)O 240690a_200011215754_100000685612 [2,0,0,0,0,0|2,0,0]=4 97 B22R1.21649 CCCCCCCCCCCNC(=O)c1ccc(c(c1)F)O 240690a_200011215754_100000185466 [2,0,0,0,0,0|2,0,0]=4 98 B22R1.21649 CCCCCCCCCCCNC(=O)c1ccc(c(c1)F)O 527a_200011215754_100000185466 [2,0,0,0,0,0|2,0,0]=4 99 B22R1.21649 CCCCCCCCCCCNC(=O)c1ccc(c(c1)O)C 240690a_200011215754_100000233767 [2,0,0,0,0,0|2,0,0]=4 100 B22R1.21649 CCCCCCCCCCCNC(=O)c1ccc(c(c1)O)F 240690a_200011215754_100000035894 [2,0,0,0,0,0|2,0,0]=4 101 B22R1.21649 CCCCCCCCCCCNC(=O)c1ccc(c(c1)O)F 527a_200011215754_100000035894 [2,0,0,0,0,0|2,0,0]=4 102 B22R1.21649 CCCCCCCCCCOCC(=O)c1ccc(c(c1)O)O 7a_100000210711_100000183813 [2,0,0,0,0,0|1,0,0]=3 103 B22R1.21649 Cc1cc(ccc1O)C(=O)CCCCCCCCCCCO 1458a_100000685612_100009812471 [2,0,0,0,0,0|2,0,0]=4 104 B22R1.21649 Cc1ccc(cc1O)C(=O)CCCCCCCCCCCO 1458a_100000233767_100009812471 [2,0,0,0,0,0|2,0,0]=4 105 B22R1.21649 O=C(CCCCCCCCCCCO)c1ccc(c(c1)F)O 1458a_100000185466_100009812471 [2,0,0,0,0,0|2,0,0]=4 106 B22R1.21649 O=C(CCCCCCCCCCCO)c1ccc(c(c1)O)F 1458a_100000035894_100009812471 [2,0,0,0,0,0|2,0,0]=4 107 B22R1.21649 O=C(CCCCCCCCCCCO)c1ccc(c(c1)O)O 1458a_100000212155_100009812471 [2,0,0,0,0,0|1,0,0]=3 108 B22R1.21649 O=C(COCCCCCCCCCBr)c1ccc(c(c1)O)O 7a_100009813782_100000183813 [2,0,0,0,0,0|2,0,0]=4 109 B22R1.21649 O=C(COCCCCCCCCCCl)c1ccc(c(c1)O)O 7a_100009868337_100000183813 [2,0,0,0,0,0|2,0,0]=4 110 B22R1.21649 O=C(CSCCCCCCCCCO)c1ccc(c(c1)O)O 62a_100009813782_100000183813 [2,0,0,0,0,0|2,0,0]=4 111 B22R1.521769 C=CCCCCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009814027 [2,0,0,0,0,0|0,0,2]=4 112 B22R1.521769 CCCCCCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215454 [2,0,0,0,0,0|0,0,0]=2 113 B22R1.521769 CCCCCCCCCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000684558_200009992764 [2,0,0,0,0,0|2,0,0]=4 114 B22R1.521769 CCCCCCCCCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000684558_200000078382 [2,0,0,0,0,0|2,0,0]=4 115 B22R1.521769 CCCCCCCCCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000684558_100009812877 [2,0,0,0,0,0|2,0,0]=4 116 B22R1.521769 CCCCCCCCCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000684558_100000031928 [2,0,0,0,0,0|2,0,0]=4 117 B22R1.521769 CCCCCCCCCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000684558_100000031928 [2,0,0,0,0,0|2,0,0]=4 118 B22R1.521769 CCCCCCCCCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000684558_100000074654 [2,0,0,0,0,0|2,0,0]=4 119 B22R1.521769 Cc1c(cc(cc1O)C(=O)CCCCCCCCCCO)O 1458a_100000031928_100009813290 [2,0,0,0,0,0|2,0,0]=4 120 B22R1.521769 O=C(CCCCCCCCCCO)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100009813290 [2,0,0,0,0,0|2,0,0]=4 121 B22R1.521769 O=C(CCCCCCCCCCO)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100009813290 [2,0,0,0,0,0|2,0,0]=4 122 B22R1.521769 O=C(CCCCCCCCCCO)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100009813290 [2,0,0,0,0,0|2,0,0]=4 123 B22R1.521769 O=C(CCCCCCCCCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009813290 [2,0,0,0,0,0|1,0,0]=3 124 B24R1.2794872 CCCCCCCCCCCCNC(=O)c1cc(cc(c1)CO)F 240690a_100000210451_100012278920 [1,1,0,0,0,0|2,0,0]=4 125 B24R1.2794872 COc1cc(cc(c1)C(=O)CCCCCCCCCCCCO)O 1458a_100000083963_100009813331 [1,1,0,0,0,0|2,0,0]=4 126 B24R1.3068159 C#CCCCCCCCCCCOCC(=O)c1cc(cc(c1)O)O 34a_100000054667_100010006762 [1,1,0,0,0,0|0,0,2]=4 127 B24R1.3068159 CCC#CCCCCCCCCOCC(=O)c1cc(cc(c1)O)O 34a_200000031908_100010006762 [1,1,0,0,0,0|0,0,2]=4 128 B24R1.3068159 CCCCCCCCC/C=C/COCC(=O)c1cc(cc(c1)O)O 34a_100015232335_100010006762 [1,1,0,0,0,0|0,0,2]=4 129 B24R1.3068159 CCCCCCCCCCCCNCC(=O)c1cc(cc(c1)O)O 2230a_100000210451_100010006762 [1,1,0,0,0,0|1,0,0]=3 130 B24R1.3068159 CCCCCCCCCCCCNCC(=O)c1cc(cc(c1)O)O 34a_100000210451_100010006762 [1,1,0,0,0,0|1,0,0]=3 131 B24R1.3068159 CCCCCCOCCOCCOCC(=O)c1cc(cc(c1)O)O 34a_100000032842_100010006762 [1,1,0,0,0,0|2,0,0]=4 132 B24R1.3068159 CCOCCCCCCCCCOCC(=O)c1cc(cc(c1)O)O 34a_100009875440_100010006762 [1,1,0,0,0,0|1,0,0]=3 133 B24R1.3068159 Cc1cc(cc(c1)C(=O)NCCCCCCCCCCCCO)O 240690a_100000066677_100000094094 [1,1,0,0,0,0|2,0,0]=4 134 B24R1.3068159 O=C(CSCCCCCCCCCCCO)c1cc(cc(c1)O)O 62a_100009812471_100010006762 [1,1,0,0,0,0|1,1,0]=4 135 B24R1.3068159 O=C(NCCCCCCCCCCCCO)c1cc(cc(c1)Br)O 240690a_100000066677_100011934545 [1,1,0,0,0,0|2,0,0]=4 136 B24R1.3068159 O=C(NCCCCCCCCCCCCO)c1cc(cc(c1)Cl)O 240690a_100000066677_100011997059 [1,1,0,0,0,0|2,0,0]=4 137 B24R1.3068159 O=C(NCCCCCCCCCCCCO)c1cc(cc(c1)F)O 240690a_100000066677_100012017291 [1,1,0,0,0,0|2,0,0]=4 138 B24R1.3068159 O=C(NCCCCCCCCCCCCO)c1cc(cc(c1)O)O 240690a_100000066677_100000690292 [1,1,0,0,0,0|1,0,0]=3 139 B24R1.2794899 CCCCCCCCCCCCNC(=O)c1ccc(c(c1)CO)F 1626a_100000210451_100011803322 [1,1,0,0,0,0|2,0,0]=4 140 B24R1.2794899 CCCCCCCCCCCCNC(=O)c1ccc(c(c1)CO)F 240690a_100000210451_100011803322 [1,1,0,0,0,0|2,0,0]=4 141 B24R1.2794899 CCCCCCCCCCCNCC(=O)c1ccc(c(c1)CO)O 34a_200011215754_100010262812 [1,1,0,0,0,0|2,0,0]=4 142 B24R1.2794899 CCCCCCCCCCCOCC(=O)c1ccc(c(c1)CO)O 34a_100000210809_100010262812 [1,1,0,0,0,0|2,0,0]=4 143 B24R1.2794899 CCCCCCCCCCCOCC(=O)c1ccc(c(c1)CO)O 7a_100000210809_100010262812 [1,1,0,0,0,0|2,0,0]=4 144 B24R1.2794899 COc1cc(ccc1O)C(=O)CCCCCCCCCCCCO 1458a_100000687070_100009813331 [1,1,0,0,0,0|2,0,0]=4 145 B24R1.2794901 CCCCCCCCCCCCNC(=O)c1ccc(c(c1)F)CO 1626a_100000210451_100000687192 [1,1,0,0,0,0|2,0,0]=4 146 B24R1.2794901 CCCCCCCCCCCCNC(=O)c1ccc(c(c1)F)CO 240690a_100000210451_100000687192 [1,1,0,0,0,0|2,0,0]=4 147 B24R1.2794901 COc1ccc(cc1O)C(=O)CCCCCCCCCCCCO 1458a_100000766810_100009813331 [1,1,0,0,0,0|2,0,0]=4 148 B24R1.3068175 C#CCCCCCCCCCCOCC(=O)c1ccc(c(c1)O)O 7a_100000054667_100000183813 [1,1,0,0,0,0|0,0,2]=4 149 B24R1.3068175 CCC#CCCCCCCCCOCC(=O)c1ccc(c(c1)O)O 7a_200000031908_100000183813 [1,1,0,0,0,0|0,0,2]=4 150 B24R1.3068175 CCCCCCCCC/C=C/COCC(=O)c1ccc(c(c1)O)O 7a_100015232335_100000183813 [1,1,0,0,0,0|0,0,2]=4 151 B24R1.3068175 CCCCCCOCCOCCOCC(=O)c1ccc(c(c1)O)O 7a_100000032842_100000183813 [1,1,0,0,0,0|2,0,0]=4 152 B24R1.3068175 CCOCCCCCCCCCOCC(=O)c1ccc(c(c1)O)O 7a_100009875440_100000183813 [1,1,0,0,0,0|1,0,0]=3 153 B24R1.3068175 Cc1cc(ccc1O)C(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000685612 [1,1,0,0,0,0|2,0,0]=4 154 B24R1.3068175 Cc1ccc(cc1O)C(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000233767 [1,1,0,0,0,0|2,0,0]=4 155 B24R1.3068175 O=C(CCCCCCCCCCCCCO)c1ccc(c(c1)O)O 1458a_100000212155_100009812470 [1,1,0,0,0,0|1,0,0]=3 156 B24R1.3068175 O=C(CSCCCCCCCCCCCO)c1ccc(c(c1)O)O 62a_100009812471_100000183813 [1,1,0,0,0,0|1,1,0]=4 157 B24R1.3068175 O=C(NCCCCCCCCCCCCO)c1ccc(c(c1)Br)O 240690a_100000066677_100000189672 [1,1,0,0,0,0|2,0,0]=4 158 B24R1.3068175 O=C(NCCCCCCCCCCCCO)c1ccc(c(c1)Cl)O 240690a_100000066677_100000212196 [1,1,0,0,0,0|2,0,0]=4 159 B24R1.3068175 O=C(NCCCCCCCCCCCCO)c1ccc(c(c1)F)O 240690a_100000066677_100000185466 [1,1,0,0,0,0|2,0,0]=4 160 B24R1.3068175 O=C(NCCCCCCCCCCCCO)c1ccc(c(c1)I)O 240690a_100000066677_100000037485 [1,1,0,0,0,0|2,0,0]=4 161 B24R1.3068175 O=C(NCCCCCCCCCCCCO)c1ccc(c(c1)O)Br 240690a_100000066677_100000689001 [1,1,0,0,0,0|2,0,0]=4 162 B24R1.3068175 O=C(NCCCCCCCCCCCCO)c1ccc(c(c1)O)Cl 240690a_100000066677_100011933997 [1,1,0,0,0,0|2,0,0]=4 163 B24R1.3068175 O=C(NCCCCCCCCCCCCO)c1ccc(c(c1)O)F 240690a_100000066677_100000035894 [1,1,0,0,0,0|2,0,0]=4 164 B24R1.3068175 O=C(NCCCCCCCCCCCCO)c1ccc(c(c1)O)I 240690a_100000066677_100000239334 [1,1,0,0,0,0|2,0,0]=4 165 B24R1.5758211 O=C(CCCCCCCCCCCCO)c1ccc(c(c1O)O)O 1458a_100000037941_100009813331 [1,1,0,0,0,0|2,0,0]=4 166 B24R1.14045170 CCCCC#CCCCCCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_200000043322 [1,1,0,0,0,0|0,0,2]=4 167 B24R1.14045170 COc1cc(cc(c1O)O)C(=O)CCCCCCCCCCCO 1458a_100000061230_100009812471 [1,1,0,0,0,0|1,0,0]=3 168 B24R1.14045171 CCCCC#CCCCCCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_200000043322 [1,1,0,0,0,0|0,0,2]=4 169 B24R1.14045171 COc1c(cc(cc1O)C(=O)CCCCCCCCCCCO)O 1458a_100000073573_100009812471 [1,1,0,0,0,0|1,0,0]=3 170 B24R1.14160032 NC(=O)CCCCCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200010167045 [1,1,0,0,0,0|1,0,1]=4 171 B24R1.22067769 CCOC(=O)CCCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100010175975 [1,1,0,0,0,0|1,0,1]=4 172 B24R1.27353161 COC(=O)CCCCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009813843 [1,1,0,0,0,0|1,0,1]=4 173 B24R1.33277503 CCCCCCCCCC(=O)OCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200010990708 [1,1,0,0,0,0|1,0,1]=4 174 B26R1.36264849 CCCCCCCCCCCC(=O)OCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100020644155 [0,2,0,0,0,0|0,0,1]=3 175 B26R1.49151694 CCOC(=O)CCCCCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009827693 [0,2,0,0,0,0|1,0,1]=4 176 B26R1.56144090 COC(=O)CCCCCCCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100010983606 [0,2,0,0,0,0|1,0,1]=4 177 B26R1.144386932 COc1cc(cc(c1O)Cl)C(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000209947 [0,2,0,0,0,0|2,0,0]=4 178 B26R1.144386933 COc1c(cc(cc1Br)C(=O)NCCCCCCCCCCCCO)O 240690a_100000066677_100010760816 [0,2,0,0,0,0|2,0,0]=4 179 B26R1.144062123 CCCCCCCCCCCCNC(=O)c1cc(c(c(c1)[N+](=O)[O-])O)O 240690a_100000210451_100009843786 [0,2,0,0,0,0|1,0,1]=4 180 B24R2.47284810 O=C(NC1CCCCCCCCCCC1)c2cc(cc(c2)F)O 11a_100011194316_100012017291 [1,0,0,1,0,0|2,0,0]=4 181 B24R2.47284810 O=C(NC1CCCCCCCCCCC1)c2cc(cc(c2)F)O 240690a_100011194316_100012017291 [1,0,0,1,0,0|2,0,0]=4 182 B24R2.47284810 O=C(NC1CCCCCCCCCCC1)c2cc(cc(c2)F)O 527a_100011194316_100012017291 [1,0,0,1,0,0|2,0,0]=4 183 B24R2.47284810 O=C(NC1CCCCCCCCCCC1)c2cc(cc(c2)O)O 240690a_100011194316_100000690292 [1,0,0,1,0,0|1,0,0]=3 184 B24R2.47284810 O=C(NC1CCCCCCCCCCC1)c2cc(cc(c2)O)O 527a_100011194316_100000690292 [1,0,0,1,0,0|1,0,0]=3 185 B24R2.16761660 O=C(NC1CCCCCCCCCCC1)c2ccc(c(c2)F)O 240690a_100011194316_100000185466 [1,0,0,1,0,0|2,0,0]=4 186 B24R2.16761660 O=C(NC1CCCCCCCCCCC1)c2ccc(c(c2)F)O 527a_100011194316_100000185466 [1,0,0,1,0,0|2,0,0]=4 187 B24R2.16761660 O=C(NC1CCCCCCCCCCC1)c2ccc(c(c2)O)F 240690a_100011194316_100000035894 [1,0,0,1,0,0|2,0,0]=4 188 B24R2.16761660 O=C(NC1CCCCCCCCCCC1)c2ccc(c(c2)O)F 527a_100011194316_100000035894 [1,0,0,1,0,0|2,0,0]=4 189 B26R2.268590065 CCCCCCCCCCCc1noc(n1)c2cc(c(c(c2)O)O)O 270196a_100000749962_100000212154 [0,1,0,1,0,0|1,0,1]=4 190 B26R2.162500849 O=C(CCCCCCCCCC1OCCO1)c2cc(c(c(c2)O)O)O 1458a_100000212154_103619048131 [0,1,0,1,0,0|2,0,0]=4 191 B26R3.3306931 Cc1c(cc(cc1O)C(=O)NC2CCCCC2C3CCCCC3)O 240690a_200011339469_100000031928 [0,0,0,2,0,0|2,0,0]=4 192 B26R3.3306931 Cc1c(cc(cc1O)C(=O)NC2CCCCC2C3CCCCC3)O 527a_200011339469_100000031928 [0,0,0,2,0,0|2,0,0]=4 193 B26R3.3306931 O=C(NC1CCCCC1C2CCCCC2)c3cc(c(c(c3)Br)O)O 240690a_200011339469_200009992764 [0,0,0,2,0,0|2,0,0]=4 194 B26R3.3306931 O=C(NC1CCCCC1C2CCCCC2)c3cc(c(c(c3)Cl)O)O 240690a_200011339469_200000078382 [0,0,0,2,0,0|2,0,0]=4 195 B26R3.3306931 O=C(NC1CCCCC1C2CCCCC2)c3cc(c(c(c3)O)Br)O 240690a_200011339469_100009812877 [0,0,0,2,0,0|2,0,0]=4 196 B26R3.3306931 O=C(NC1CCCCC1C2CCCCC2)c3cc(c(c(c3)O)Cl)O 240690a_200011339469_100000074654 [0,0,0,2,0,0|2,0,0]=4 197 B24R1.2874770 CCCCCCCCCCCCNC(=O)Cc1cc(cc(c1)O)O 240690a_100000210451_100000080560 [1,0,0,0,0,1|1,0,0]=3 198 B24R1.2874770 CCCCCCCCCCCCNC(=O)Cc1cc(cc(c1)O)O 527a_100000210451_100000080560 [1,0,0,0,0,1|1,0,0]=3 199 B24R1.2874785 CCCCCCCCCCCCNC(=O)Cc1ccc(c(c1)O)O 527a_100000210451_100000031429 [1,0,0,0,0,1|1,0,0]=3 200 B24R1.2874785 O=C(CCCCCCCCCCCCO)Cc1ccc(c(c1)O)O 1458a_100000031429_100009813331 [1,0,0,0,0,1|2,0,0]=4 201 B24R1.2874785 O=C(CCCCCCCCCCCCO)Nc1ccc(c(c1)O)O 22a_100102946323_100102582631 [1,0,0,0,0,1|2,0,0]=4