0 B12R0.233 CCCCCC(=O)OCCC(C)C CSC000024457 [0,0,0,0,0,0|3,0,1]=4 1 B12R0.233 CCCSCC(=O)NCCC(=O)O CSC012904872 [0,0,0,0,0,0|2,0,0]=2 2 B12R0.233 COCCNC(=O)CSCC(=O)O CSC000150188 [0,0,0,0,0,0|3,0,0]=3 3 B11R0.140 CCCCCC(=O)OCCCC CSC011212308 [1,0,0,0,0,0|2,0,1]=4 4 B11R0.148 CCCCCCCCCC(=O)N CSC011216713 [1,0,0,0,0,0|1,0,1]=3 5 B13R0.1 CCC=CCNC(=O)NCCC(=O)O CSC057728787 [0,1,0,0,0,0|1,0,2]=4 6 B13R0.1 CCCCOCC(=O)NCCC(=O)O CSC012904886 [0,1,0,0,0,0|1,0,0]=2 7 B13R0.1 CCOCCCC(=O)NCCC(=O)O CSC011593163 [0,1,0,0,0,0|1,0,0]=2 8 B13R0.1 COCCCCC(=O)NCCC(=O)O CSC019947150 [0,1,0,0,0,0|1,0,0]=2 9 B13R0.1 COCCOCC(=O)NCCC(=O)O CSC000205649 [0,1,0,0,0,0|2,0,0]=3 10 B13R0.1 CSCCCCC(=O)NCCC(=O)O CSC018722141 [0,1,0,0,0,0|1,0,0]=2 11 B13R0.1 CSCCCNC(=O)NCCC(=O)O CSC011959772 [0,1,0,0,0,0|2,0,0]=3 12 B13R0.1 OC(=O)CCNC(=O)NCCCC=C CSC014618778 [0,1,0,0,0,0|1,0,2]=4 13 B13R0.139 CCCCCC(=O)N(C)CCC(=O)O CSC011389226 [0,1,0,0,0,0|1,0,0]=2 14 B13R0.139 CCCOCC(=O)N(C)CCC(=O)O CSC012905538 [0,1,0,0,0,0|2,0,0]=3 15 B13R0.139 CCCSCC(=O)N(C)CCC(=O)O CSC012905531 [0,1,0,0,0,0|2,0,0]=3 16 B13R0.139 CCOCCC(=O)N(C)CCC(=O)O CSC011707978 [0,1,0,0,0,0|2,0,0]=3 17 B13R0.139 COCCCC(=O)N(C)CCC(=O)O CSC011593250 [0,1,0,0,0,0|2,0,0]=3 18 B13R0.153 CCOCCN(CC)CCCC(=O)O CSC011905687 [0,1,0,0,0,0|3,0,0]=4 19 B13R0.194 CCCCCC(=O)NCCC(=O)NC CSC026851988 [0,1,0,0,0,0|2,0,0]=3 20 B13R0.194 CNCCCC(=O)NCCC(=O)OC CSC011437923 [0,1,0,0,0,0|2,0,0]=3 21 B13R0.331 CCCC(C)CC(=O)NCCC(=O)O CSC012904899 [0,1,0,0,0,0|1,0,0]=2 22 B13R0.331 COCC(C)CC(=O)NCCC(=O)O CSC012736024 [0,1,0,0,0,0|2,0,0]=3 23 B13R0.331 COC[C@@H](C)NC(=O)CSCC(=O)O CSC017448135 [0,1,0,0,0,0|3,0,0]=4 24 B13R0.331 CSCC(C)NC(=O)NCCC(=O)O CSC013449367 [0,1,0,0,0,0|3,0,0]=4 25 B13R0.333 CCCCCC(=O)NC(C)CC(=O)O CSC000244157 [0,1,0,0,0,0|1,0,0]=2 26 B13R0.333 CCCOCC(=O)NC(C)CC(=O)O CSC012905357 [0,1,0,0,0,0|2,0,0]=3 27 B13R0.333 CCCSCC(=O)NC(C)CC(=O)O CSC012905349 [0,1,0,0,0,0|2,0,0]=3 28 B13R0.333 CCOCCC(=O)NC(C)CC(=O)O CSC011275203 [0,1,0,0,0,0|2,0,0]=3 29 B13R0.333 COCCCC(=O)NC(C)CC(=O)O CSC012736046 [0,1,0,0,0,0|2,0,0]=3 30 B13R0.333 COCCNC(=O)CC(C)CC(=O)O CSC011778254 [0,1,0,0,0,0|2,0,0]=3 31 B13R0.339 CCCCCC(=O)NCC(C)C(=O)O CSC011724763 [0,1,0,0,0,0|1,0,0]=2 32 B13R0.339 CCCOCC(=O)NCC(C)C(=O)O CSC012905585 [0,1,0,0,0,0|2,0,0]=3 33 B13R0.339 CCCSCC(=O)NCC(C)C(=O)O CSC012905577 [0,1,0,0,0,0|2,0,0]=3 34 B13R0.339 CCOCCC(=O)NCC(C)C(=O)O CSC011724816 [0,1,0,0,0,0|2,0,0]=3 35 B13R0.339 COCCCC(=O)NCC(C)C(=O)O CSC012736112 [0,1,0,0,0,0|2,0,0]=3 36 B13R0.345 CCCCC(C)C(=O)NCCC(=O)O CSC014590845 [0,1,0,0,0,0|1,0,0]=2 37 B13R0.345 CCCCC(C)C(C)NCCC(=O)O CSC057009880 [0,1,0,0,0,0|2,0,1]=4 38 B13R0.345 CCCCN(C)C(=O)NCCC(=O)O CSC011427974 [0,1,0,0,0,0|2,0,0]=3 39 B13R0.345 COCCN(C)C(=O)NCCC(=O)O CSC011477063 [0,1,0,0,0,0|3,0,0]=4 40 B13R0.345 CSCCC(C)N(C)CCCC(=O)O CSC012996122 [0,1,0,0,0,0|3,0,0]=4 41 B13R0.493 CCC(=C)CNC(=O)NCCC(=O)O CSC020294853 [0,1,0,0,0,0|2,0,1]=4 42 B13R0.493 CCC(C)OCC(=O)NCCC(=O)O CSC020437953 [0,1,0,0,0,0|2,0,0]=3 43 B13R0.493 COC(C)CCC(=O)NCCC(=O)O CSC013304257 [0,1,0,0,0,0|2,0,0]=3 44 B13R0.493 CSC(C)CNC(=O)NCCC(=O)O CSC013439026 [0,1,0,0,0,0|3,0,0]=4 45 B13R0.1259 CCCCCS(=O)(=O)NCCC(=O)O CSC017469898 [0,1,0,0,0,0|2,0,0]=3 46 B13R0.1259 CCOCCS(=O)(=O)NCCC(=O)O CSC011832517 [0,1,0,0,0,0|3,0,0]=4 47 B13R0.1259 COCCCS(=O)(=O)NCCC(=O)O CSC011838779 [0,1,0,0,0,0|3,0,0]=4 48 B13R0.1259 OC(=O)CCNS(=O)(=O)CCCCF CSC019528519 [0,1,0,0,0,0|3,0,0]=4 49 B13R0.1398 CC(=C)CCNC(=O)NCCC(=O)O CSC019522977 [0,1,0,0,0,0|2,0,1]=4 50 B13R0.1398 CC(C)CCNC(=O)CCNC(=O)N CSC059762253 [0,1,0,0,0,0|3,0,0]=4 51 B13R0.1398 CC(C)CCNC(=O)NCCC(=O)N CSC059285309 [0,1,0,0,0,0|3,0,0]=4 52 B13R0.1398 CC(C)CCNC(=O)NCCC(=O)O CSC011427812 [0,1,0,0,0,0|2,0,0]=3 53 B13R0.1398 CC(C)OCCC(=O)NCCC(=O)O CSC012904873 [0,1,0,0,0,0|2,0,0]=3 54 B13R1.149 CC1CN(CCS1)CCCC(=O)O CSC012047031 [0,0,0,1,0,0|3,0,0]=4 55 B13R1.342 NC(=O)CCNC(=O)C1CCCS1 CSC016326993 [0,0,0,1,0,0|3,0,0]=4 56 B13R1.342 OC(=O)CSCC(=O)N1CCCC1 CSC000150313 [0,0,0,1,0,0|2,0,0]=3 57 B13R1.342 OC(=O)CSCC(=O)N1CCCC1 CSC000150313 [0,0,0,1,0,0|2,0,0]=3 58 B13R1.658 CCSCCN1CCC(C1)C(=O)O CSC012934413 [0,0,0,1,0,0|3,0,0]=4 59 B13R1.1047 NC(=O)CSCC(=O)NC1CCC1 CSC017133211 [0,0,0,1,0,0|3,0,0]=4 60 B13R1.1048 NC(=O)CSCC(=O)NCC1CC1 CSC019115294 [0,0,0,1,0,0|3,0,0]=4 61 B13R1.3731 CC1CC1NC(=O)CSCC(=O)N CSC017416787 [0,0,0,1,0,0|3,0,0]=4 62 B13R1.3787 CC1CCCC(N1CCC(=O)O)C CSC046098707 [0,0,0,1,0,0|2,0,1]=4 63 B11R0.46 CCCCNC(=O)CCC(=O)O CSC000199522 [0,0,0,0,1,0|1,0,0]=2 64 B11R0.46 CCCCNC(=O)NCC(=O)O CSC011205310 [0,0,0,0,1,0|2,0,0]=3 65 B11R0.46 CCCCOC(=O)CCC(=O)C CSC011212340 [0,0,0,0,1,0|2,0,0]=3 66 B11R0.46 COCCNC(=O)CCC(=O)O CSC011309817 [0,0,0,0,1,0|2,0,0]=3 67 B13R0.188 CCCCCC(=O)NCCCC(=O)O CSC000244082 [0,0,0,0,0,1|0,0,0]=1 68 B13R0.188 CCCOCC(=O)NCCCC(=O)O CSC012904428 [0,0,0,0,0,1|1,0,0]=2 69 B13R0.188 CCCSCC(=O)NCCCC(=O)O CSC012904421 [0,0,0,0,0,1|1,0,0]=2 70 B13R0.188 CCOCCC(=O)NCCCC(=O)O CSC011274717 [0,0,0,0,0,1|1,0,0]=2 71 B13R0.188 COCCCC(=O)NCCCC(=O)O CSC011593005 [0,0,0,0,0,1|1,0,0]=2 72 B13R0.188 OC(=O)CCCNC(=O)COCC=C CSC019195644 [0,0,0,0,0,1|1,0,2]=4 73 B10R0.91 CCCCCC(=O)OCC=C CSC000006420 [2,0,0,0,0,0|1,0,1]=4 74 B10R0.91 CCCCCC(=O)OCCC CSC000170158 [2,0,0,0,0,0|1,0,1]=4 75 B10R0.3 CCOC(=O)CCCC(=O)C CSC000032325 [2,0,0,0,0,0|2,0,0]=4 76 B10R0.3 COCC(=O)NCCC(=O)O CSC000195326 [2,0,0,0,0,0|2,0,0]=4 77 B10R0.4 CCCCCCCNC(=O)C CSC009862821 [2,0,0,0,0,0|2,0,0]=4 78 B10R0.4 CCCCCCCNC(=O)N CSC009878357 [2,0,0,0,0,0|2,0,0]=4 79 B10R0.4 CCCCCCCOC(=O)C CSC000036323 [2,0,0,0,0,0|2,0,0]=4 80 B12R0.47 CCCCCOC(=O)CCCCC CSC000039363 [1,1,0,0,0,0|1,0,1]=4 81 B12R0.2 CCCNC(=O)CC(C)CC(=O)O CSC011778250 [1,1,0,0,0,0|1,0,0]=3 82 B12R0.54 CSCC(C)C(=O)NCCC(=O)O CSC012904893 [1,1,0,0,0,0|2,0,0]=4 83 B12R0.234 CCCCCCCCCOC(=O)C CSC000210669 [1,1,0,0,0,0|1,0,1]=4 84 B12R0.234 CCCCCCCCSCC(=O)N CSC046179943 [1,1,0,0,0,0|1,0,1]=4 85 B12R0.248 CCCCCCCCCC(=O)NN CSC011221126 [1,1,0,0,0,0|1,0,1]=4 86 B12R0.248 CCCCCCCCCC(=O)OC CSC011215519 [1,1,0,0,0,0|0,0,1]=3 87 B12R0.248 CCCCCCCSCC(=O)OC CSC000048336 [1,1,0,0,0,0|1,0,1]=4 88 B12R0.123 CCCSCC(=O)NC(C)C(=O)O CSC012905436 [0,1,0,0,1,0|2,0,0]=4 89 B12R0.123 CCCSCC(=O)N[C@@H](C)C(=O)O CSC012905627 [0,1,0,0,1,0|2,0,0]=4 90 B12R0.123 CCCSCC(=O)N[C@H](C)C(=O)O CSC012905774 [0,1,0,0,1,0|2,0,0]=4 91 B12R0.141 CCCSCC(=O)N(C)CC(=O)O CSC012904764 [0,1,0,0,1,0|2,0,0]=4 92 B12R0.645 CCCCCS(=O)(=O)NCC(=O)O CSC010439251 [0,1,0,0,1,0|2,0,0]=4 93 B14R0.46 CCCCC(C)C(=O)NCCCC(=O)O CSC014590848 [0,1,0,0,0,1|0,0,0]=2 94 B14R0.46 CCCCC(C)C(C)NCCCC(=O)O CSC057309726 [0,1,0,0,0,1|1,0,1]=4 95 B14R0.46 CCCCN(C)C(=O)NCCCC(=O)O CSC011427975 [0,1,0,0,0,1|1,0,0]=3 96 B14R0.67 CC(=C)CCNC(=O)NCCCC(=O)O CSC019159195 [0,1,0,0,0,1|1,0,1]=4 97 B14R0.67 CC(C)CCCC(C)NCCCC(=O)O CSC011483732 [0,1,0,0,0,1|1,0,1]=4 98 B14R0.67 CC(C)CCNC(=O)NCCCC(=O)O CSC011427813 [0,1,0,0,0,1|1,0,0]=3 99 B14R0.67 CC(C)OCCC(=O)NCCCC(=O)O CSC012904422 [0,1,0,0,0,1|1,0,0]=3 100 B14R0.186 CCCCCC(=O)N(C)CCCC(=O)O CSC000244134 [0,1,0,0,0,1|0,0,0]=2 101 B14R0.186 CCCOCC(=O)N(C)CCCC(=O)O CSC012904844 [0,1,0,0,0,1|1,0,0]=3 102 B14R0.186 CCCSCC(=O)N(C)CCCC(=O)O CSC012904842 [0,1,0,0,0,1|1,0,0]=3 103 B14R0.186 CCOCCC(=O)N(C)CCCC(=O)O CSC011275146 [0,1,0,0,0,1|1,0,0]=3 104 B14R0.186 COCCCC(=O)N(C)CCCC(=O)O CSC011593237 [0,1,0,0,0,1|1,0,0]=3 105 B14R0.226 CNCCCC(=O)NCCCC(=O)OC CSC011437441 [0,1,0,0,0,1|1,0,0]=3 106 B14R0.227 CCCCCC(=O)NCC(C)CC(=O)O CSC012854581 [0,1,0,0,0,1|0,0,0]=2 107 B14R0.227 CCCOCC(=O)NCC(C)CC(=O)O CSC013226558 [0,1,0,0,0,1|1,0,0]=3 108 B14R0.227 CCCSCC(=O)NCC(C)CC(=O)O CSC013226567 [0,1,0,0,0,1|1,0,0]=3 109 B14R0.227 CCOCCC(=O)NCC(C)CC(=O)O CSC012854591 [0,1,0,0,0,1|1,0,0]=3 110 B14R0.227 COCCCC(=O)NCC(C)CC(=O)O CSC012854659 [0,1,0,0,0,1|1,0,0]=3 111 B14R0.1749 CCC(=C)CNC(=O)NCCCC(=O)O CSC019489968 [0,1,0,0,0,1|1,0,1]=4 112 B14R0.1749 CCC(C)OCC(=O)NCCCC(=O)O CSC020363965 [0,1,0,0,0,1|1,0,0]=3 113 B14R0.1749 COC(C)CCC(=O)NCCCC(=O)O CSC013304258 [0,1,0,0,0,1|1,0,0]=3 114 B14R0.1749 CSC(C)CNC(=O)NCCCC(=O)O CSC013438994 [0,1,0,0,0,1|2,0,0]=4 115 B14R0.2224 CC#CCCNC(=O)NCCCC(=O)O CSC013612742 [0,1,0,0,0,1|0,0,2]=4 116 B14R0.2224 CCC=CCNC(=O)NCCCC(=O)O CSC057669202 [0,1,0,0,0,1|0,0,2]=4 117 B14R0.2224 CCOCCCC(=O)NCCCC(=O)O CSC011593006 [0,1,0,0,0,1|0,0,0]=2 118 B14R0.2224 COCCCCC(=O)NCCCC(=O)O CSC012904424 [0,1,0,0,0,1|0,0,0]=2 119 B14R0.2224 COCCOCC(=O)NCCCC(=O)O CSC000205589 [0,1,0,0,0,1|1,0,0]=3 120 B14R0.2224 CSCCCCC(=O)NCCCC(=O)O CSC017468522 [0,1,0,0,0,1|0,0,0]=2 121 B14R0.2224 CSCCCNC(=O)NCCCC(=O)O CSC011959755 [0,1,0,0,0,1|1,0,0]=3 122 B14R0.2224 OC(=O)CCCNC(=O)NCCCC=C CSC014618779 [0,1,0,0,0,1|0,0,2]=4 123 B14R0.2370 CCCCCS(=O)(=O)NCCCC(=O)O CSC017051306 [0,1,0,0,0,1|1,0,0]=3 124 B14R0.2370 CCOCCS(=O)(=O)NCCCC(=O)O CSC011832519 [0,1,0,0,0,1|2,0,0]=4 125 B14R0.2370 COCCCS(=O)(=O)NCCCC(=O)O CSC011838781 [0,1,0,0,0,1|2,0,0]=4 126 B14R0.2370 OC(=O)CCCNS(=O)(=O)CCCCF CSC017465250 [0,1,0,0,0,1|2,0,0]=4 127 B14R0.2863 CCCC(C)CC(=O)NCCCC(=O)O CSC012904435 [0,1,0,0,0,1|0,0,0]=2 128 B14R0.2863 COCC(C)CC(=O)NCCCC(=O)O CSC012736025 [0,1,0,0,0,1|1,0,0]=3 129 B14R0.2863 CSCC(C)NC(=O)NCCCC(=O)O CSC013449334 [0,1,0,0,0,1|2,0,0]=4 130 B14R0.2 CCCCCCNC(=O)NCCC(=O)O CSC012024110 [0,2,0,0,0,0|1,0,0]=3 131 B14R0.2 CCCCSCCC(=O)NCCC(=O)O CSC012904895 [0,2,0,0,0,0|1,0,0]=3 132 B14R0.2 CCSCCCNC(=O)NCCC(=O)O CSC014594941 [0,2,0,0,0,0|1,0,0]=3 133 B14R0.2 CN(CCCCCC=C)CCCC(=O)O CSC012140175 [0,2,0,0,0,0|2,0,0]=4 134 B14R0.2 COCCOCCC(=O)NCCC(=O)O CSC017466268 [0,2,0,0,0,0|1,0,0]=3 135 B14R0.2 OC(=O)CCNC(=O)CCCOCC=C CSC012904906 [0,2,0,0,0,0|1,0,1]=4 136 B14R0.2 OC(=O)CCNC(=O)NCCCCC=C CSC014919374 [0,2,0,0,0,0|1,0,1]=4 137 B14R0.12 COCCNCC(=O)NCCC(=O)OC CSC000212497 [0,2,0,0,0,0|2,0,0]=4 138 B14R0.180 CCCCOCC(=O)NCC(C)C(=O)O CSC012905587 [0,2,0,0,0,0|1,0,0]=3 139 B14R0.180 CCOCCCC(=O)NCC(C)C(=O)O CSC012736114 [0,2,0,0,0,0|1,0,0]=3 140 B14R0.180 COCCCCC(=O)NCC(C)C(=O)O CSC012905581 [0,2,0,0,0,0|1,0,0]=3 141 B14R0.180 COCCOCC(=O)NCC(C)C(=O)O CSC011724784 [0,2,0,0,0,0|2,0,0]=4 142 B14R0.389 CCCCOCC(=O)NC(C)CC(=O)O CSC012905359 [0,2,0,0,0,0|1,0,0]=3 143 B14R0.389 CCOCCCC(=O)NC(C)CC(=O)O CSC012736048 [0,2,0,0,0,0|1,0,0]=3 144 B14R0.389 COCCCCC(=O)NC(C)CC(=O)O CSC012905353 [0,2,0,0,0,0|1,0,0]=3 145 B14R0.389 COCCOCC(=O)NC(C)CC(=O)O CSC011275200 [0,2,0,0,0,0|2,0,0]=4 146 B14R0.511 CCCCOCC(=O)N(C)CCC(=O)O CSC012905540 [0,2,0,0,0,0|1,0,0]=3 147 B14R0.511 CCOCCCC(=O)N(C)CCC(=O)O CSC011593258 [0,2,0,0,0,0|1,0,0]=3 148 B14R0.511 COCCCCC(=O)N(C)CCC(=O)O CSC012905534 [0,2,0,0,0,0|1,0,0]=3 149 B14R0.511 COCCOCC(=O)N(C)CCC(=O)O CSC011389247 [0,2,0,0,0,0|2,0,0]=4 150 B14R0.511 CSCCCCC(=O)N(C)CCC(=O)O CSC018780536 [0,2,0,0,0,0|1,0,0]=3 151 B14R0.241 CCCCCC(=O)N(C)CC(C)C(=O)O CSC011509926 [0,2,0,0,0,0|1,0,0]=3 152 B14R0.241 CCCOCC(=O)N(C)CC(C)C(=O)O CSC012905518 [0,2,0,0,0,0|2,0,0]=4 153 B14R0.241 CCCSCC(=O)N(C)CC(C)C(=O)O CSC012905516 [0,2,0,0,0,0|2,0,0]=4 154 B14R0.241 CCOCCC(=O)N(C)CC(C)C(=O)O CSC011707998 [0,2,0,0,0,0|2,0,0]=4 155 B14R0.241 COCCCC(=O)N(C)CC(C)C(=O)O CSC011593263 [0,2,0,0,0,0|2,0,0]=4 156 B14R0.242 CCCCCC(=O)N(CC)CCC(=O)O CSC011395407 [0,2,0,0,0,0|1,0,0]=3 157 B14R0.242 CCCOCC(=O)N(CC)CCC(=O)O CSC012905046 [0,2,0,0,0,0|2,0,0]=4 158 B14R0.242 CCCSCC(=O)N(CC)CCC(=O)O CSC012905043 [0,2,0,0,0,0|2,0,0]=4 159 B14R0.242 CCN(CCC(=O)O)C(=O)CCCOC CSC012736072 [0,2,0,0,0,0|2,0,0]=4 160 B14R0.242 CCOCCC(=O)N(CC)CCC(=O)O CSC011707981 [0,2,0,0,0,0|2,0,0]=4 161 B14R0.1172 CCCC(C)CC(=O)N(C)CCC(=O)O CSC012905546 [0,2,0,0,0,0|1,0,0]=3 162 B14R0.1172 COCC(C)CC(=O)N(C)CCC(=O)O CSC012736065 [0,2,0,0,0,0|2,0,0]=4 163 B14R0.1421 CC(C)OCCC(=O)N(C)CCC(=O)O CSC012905532 [0,2,0,0,0,0|2,0,0]=4 164 B14R0.1477 CCC(C)OCC(=O)N(C)CCC(=O)O CSC020174472 [0,2,0,0,0,0|2,0,0]=4 165 B14R0.1477 COC(C)CCC(=O)N(C)CCC(=O)O CSC013304270 [0,2,0,0,0,0|2,0,0]=4 166 B14R0.2447 CCCCC(C)C(=O)N(C)CCC(=O)O CSC014590874 [0,2,0,0,0,0|1,0,0]=3 167 B14R0.2505 CCCCCS(=O)(=O)N(C)CCC(=O)O CSC019840051 [0,2,0,0,0,0|2,0,0]=4 168 B14R0.1348 CCCCCN(CCCC(=O)O)C(C)C CSC011355905 [0,2,0,0,0,0|2,0,0]=4 169 B14R0.2356 CCCCCN(CCO)CCCC(=O)O CSC018780484 [0,2,0,0,0,0|1,0,1]=4 170 B14R0.244 CNCCCC(=O)NCC(C)C(=O)OC CSC056980067 [0,2,0,0,0,0|2,0,0]=4 171 B14R0.2691 CC(C)(C)CCCC(=O)NCCC(=O)O CSC012904902 [0,2,0,0,0,0|1,0,0]=3 172 B14R0.2691 CC(C)(C)CCNC(=O)NCCC(=O)O CSC013534188 [0,2,0,0,0,0|2,0,0]=4 173 B14R0.119 CCCC(C)CC(=O)NCC(C)C(=O)O CSC012905596 [0,2,0,0,0,0|1,0,0]=3 174 B14R0.125 CCCC(C)N(C)C(=O)NCCC(=O)O CSC011429277 [0,2,0,0,0,0|2,0,0]=4 175 B14R0.390 CCCC(C)CC(=O)NC(C)CC(=O)O CSC012905367 [0,2,0,0,0,0|1,0,0]=3 176 B14R0.426 CC(C)CC(C)CC(=O)NCCC(=O)O CSC012904870 [0,2,0,0,0,0|1,0,0]=3 177 B14R0.426 CC(C)CC(C)NC(=O)CSCC(=O)O CSC013367595 [0,2,0,0,0,0|2,0,0]=4 178 B14R0.426 CC(C)CC(C)NC(=O)NCCC(=O)O CSC011429017 [0,2,0,0,0,0|2,0,0]=4 179 B14R0.426 CC(C)OCCC(=O)NC(C)CC(=O)O CSC012905351 [0,2,0,0,0,0|2,0,0]=4 180 B14R0.642 CCC(C)C(C)NC(=O)NCCC(=O)O CSC011483017 [0,2,0,0,0,0|2,0,0]=4 181 B14R0.1576 CCCC(C)(C)NC(=O)NCCC(=O)O CSC013446870 [0,2,0,0,0,0|2,0,0]=4 182 B14R0.1576 CCCS(=O)(=O)CC(=O)NCCC(=O)O CSC018956111 [0,2,0,0,0,0|2,0,0]=4 183 B14R0.1919 CCCC(CC)NC(=O)NCCC(=O)O CSC011608286 [0,2,0,0,0,0|2,0,0]=4 184 B14R0.2211 CCCC(C)CS(=O)(=O)NCCC(=O)O CSC017173085 [0,2,0,0,0,0|2,0,0]=4 185 B14R0.44 CCCCC(C)C(=O)NC(C)CC(=O)O CSC014590868 [0,2,0,0,0,0|1,0,0]=3 186 B14R0.526 CCCCCC(=O)NC(C)C(C)C(=O)O CSC013349336 [0,2,0,0,0,0|1,0,0]=3 187 B14R0.526 CCCCNC(=O)CN(C)C(C)C(=O)O CSC011716842 [0,2,0,0,0,0|2,0,0]=4 188 B14R0.526 CCCOCC(=O)NC(C)C(C)C(=O)O CSC014312843 [0,2,0,0,0,0|2,0,0]=4 189 B14R0.526 CCCSCC(=O)NC(C)C(C)C(=O)O CSC057032993 [0,2,0,0,0,0|2,0,0]=4 190 B14R0.1747 CCC(C)OCC(=O)NC(C)CC(=O)O CSC019763917 [0,2,0,0,0,0|2,0,0]=4 191 B14R0.1747 COC(C)CCC(=O)NC(C)CC(=O)O CSC013304265 [0,2,0,0,0,0|2,0,0]=4 192 B14R0.222 CC(C)OCCC(=O)NCC(C)C(=O)O CSC012905579 [0,2,0,0,0,0|2,0,0]=4 193 B14R0.248 CCC(C)OCC(=O)NCC(C)C(=O)O CSC019346915 [0,2,0,0,0,0|2,0,0]=4 194 B14R0.248 COC(C)CCC(=O)NCC(C)C(=O)O CSC013304285 [0,2,0,0,0,0|2,0,0]=4 195 B14R0.396 CCCCC(C)C(=O)NCC(C)C(=O)O CSC014590899 [0,2,0,0,0,0|1,0,0]=3 196 B14R0.455 CCCCCC(=O)NCC(C)(C)C(=O)O CSC012905941 [0,2,0,0,0,0|1,0,0]=3 197 B14R0.455 CCCCCC(=O)NCC(C)(O)C(=O)O CSC012429285 [0,2,0,0,0,0|1,0,0]=3 198 B14R0.455 CCCOCC(=O)NCC(C)(C)C(=O)O CSC012905977 [0,2,0,0,0,0|2,0,0]=4 199 B14R0.455 CCCOCC(=O)NCC(C)(O)C(=O)O CSC013555256 [0,2,0,0,0,0|2,0,0]=4 200 B14R0.455 CCCSCC(=O)NCC(C)(C)C(=O)O CSC012905957 [0,2,0,0,0,0|2,0,0]=4 201 B14R0.455 CCCSCC(=O)NCC(C)(O)C(=O)O CSC017469465 [0,2,0,0,0,0|2,0,0]=4 202 B14R0.455 CCOCCC(=O)NCC(C)(C)C(=O)O CSC012906032 [0,2,0,0,0,0|2,0,0]=4 203 B14R0.455 CCOCCC(=O)NCC(C)(O)C(=O)O CSC012429205 [0,2,0,0,0,0|2,0,0]=4 204 B14R0.455 COCCCC(=O)NCC(C)(C)C(=O)O CSC012905986 [0,2,0,0,0,0|2,0,0]=4 205 B14R0.455 COCCCC(=O)NCC(C)(O)C(=O)O CSC012736179 [0,2,0,0,0,0|2,0,0]=4 206 B14R0.254 CCC(C)CN(C)C(=O)NCCC(=O)O CSC011428928 [0,2,0,0,0,0|2,0,0]=4 207 B14R0.2905 CCCCC(CC)C(=O)NCCC(=O)O CSC011249631 [0,2,0,0,0,0|1,0,0]=3 208 B14R0.2905 CCCCN(CC)C(=O)NCCC(=O)O CSC011427995 [0,2,0,0,0,0|2,0,0]=4 209 B14R0.63 CCC(CC)CNC(=O)NCCC(=O)O CSC013534967 [0,2,0,0,0,0|2,0,0]=4 210 B14R0.63 CCC(CNC(=O)NCCC(=O)O)OC CSC019936197 [0,2,0,0,0,0|2,0,0]=4 211 B14R0.1889 CCC(C)(C)CNC(=O)NCCC(=O)O CSC014020081 [0,2,0,0,0,0|2,0,0]=4 212 B12R1.54 OC(=O)CCC(=O)N1CCCC1 CSC000187315 [0,0,0,1,1,0|1,0,0]=3 213 B12R1.226 CC1CCCN(C1)CCC(=O)O CSC025718150 [0,0,0,1,1,0|2,0,0]=4 214 B14R1.418 NC(=O)CCCNC(=O)C1CCSC1 CSC061174977 [0,0,0,1,0,1|2,0,0]=4 215 B14R1.418 NC(=O)CCCNC(=O)[C@H]1CCCO1 CSC061824482 [0,0,0,1,0,1|2,0,0]=4 216 B14R1.418 OC(=O)CCCNC(=O)C1CCCO1 CSC000194778 [0,0,0,1,0,1|1,0,0]=3 217 B14R1.418 OC(=O)CCCNC(=O)C1CCOC1 CSC011441834 [0,0,0,1,0,1|1,0,0]=3 218 B14R1.4826 CC1CC1NC(=O)NCCCC(=O)O CSC011670126 [0,0,0,1,0,1|1,0,0]=3 219 B14R1.6367 OC(=O)CCCNC(=O)NCC1CC1 CSC011427494 [0,0,0,1,0,1|1,0,0]=3 220 B14R1.37 CCOCCNC(=O)C1CCC(=O)N1 CSC061550214 [0,1,0,1,0,0|2,0,0]=4 221 B14R1.37 COCCCNC(=O)C1CCC(=O)N1 CSC046105090 [0,1,0,1,0,0|2,0,0]=4 222 B14R1.37 COCCCNC(=O)C1CCC(=O)N1 CSC046105090 [0,1,0,1,0,0|2,0,0]=4 223 B14R1.37 CSCCCNC(=O)C1CCC(=O)N1 CSC061149504 [0,1,0,1,0,0|2,0,0]=4 224 B14R1.76 CCC1CN(CCS1)CCCC(=O)O CSC012493603 [0,1,0,1,0,0|2,0,0]=4 225 B14R1.420 NC(=O)CCCC(=O)N1CCCCO1 CSC060883492 [0,1,0,1,0,0|2,0,0]=4 226 B14R1.420 NC(=O)CCNC(=O)C1CCCCO1 CSC060764844 [0,1,0,1,0,0|2,0,0]=4 227 B14R1.420 NC(=O)CCNC(=O)C1CCCCS1 CSC061546999 [0,1,0,1,0,0|2,0,0]=4 228 B14R1.420 NC(=O)CCNC(=O)C1CCSCC1 CSC061521337 [0,1,0,1,0,0|2,0,0]=4 229 B14R1.420 NC(=O)CSCC(=O)N1CCCCC1 CSC011200862 [0,1,0,1,0,0|2,0,0]=4 230 B14R1.420 OC(=O)CCNC(=O)C1CCCCO1 CSC011625457 [0,1,0,1,0,0|1,0,0]=3 231 B14R1.420 OC(=O)CCNC(=O)C1CCCOC1 CSC011744380 [0,1,0,1,0,0|1,0,0]=3 232 B14R1.420 OC(=O)CCNC(=O)C1CCSCC1 CSC016379853 [0,1,0,1,0,0|1,0,0]=3 233 B14R1.420 OC(=O)CCNC(=O)N1CCOCC1 CSC011426985 [0,1,0,1,0,0|2,0,0]=4 234 B14R1.420 OC(=O)CCNC(=O)N1CCSCC1 CSC011428339 [0,1,0,1,0,0|2,0,0]=4 235 B14R1.810 NC(=O)CCCC(=O)NC1CCSC1 CSC060829568 [0,1,0,1,0,0|2,0,0]=4 236 B14R1.810 NC(=O)CCNC(=O)CC1CCCO1 CSC061467755 [0,1,0,1,0,0|2,0,0]=4 237 B14R1.810 NC(=O)CSCC(=O)NC1CCCC1 CSC060875156 [0,1,0,1,0,0|2,0,0]=4 238 B14R1.810 OC(=O)CCNC(=O)CC1CCCO1 CSC011593165 [0,1,0,1,0,0|1,0,0]=3 239 B14R1.810 OC(=O)CCNC(=O)NC1CCCC1 CSC011205375 [0,1,0,1,0,0|1,0,0]=3 240 B14R1.810 OC(=O)CSCC(=O)NC1CCSC1 CSC013936583 [0,1,0,1,0,0|2,0,0]=4 241 B14R1.1469 NC(=O)CSCC(=O)NCC1CCC1 CSC060412325 [0,1,0,1,0,0|2,0,0]=4 242 B14R1.1469 OC(=O)CCNC(=O)NCC1CCC1 CSC011428949 [0,1,0,1,0,0|1,0,0]=3 243 B14R1.1470 OC(=O)CCNC(=O)COCC1CC1 CSC017046038 [0,1,0,1,0,0|1,0,0]=3 244 B14R1.1634 CC[C@@H]1C[C@H]1NC(=O)CSCC(=O)N CSC060445672 [0,1,0,1,0,0|2,0,0]=4 245 B14R1.1634 CC[C@@H]1C[C@H]1NC(=O)NCCC(=O)O CSC057170804 [0,1,0,1,0,0|1,0,0]=3 246 B14R1.4488 CC1CCCN1C(=O)CSCC(=O)N CSC060719802 [0,1,0,1,0,0|2,0,0]=4 247 B14R1.4488 CC1CCCN1C(=O)NCCC(=O)O CSC011429591 [0,1,0,1,0,0|1,0,0]=3 248 B14R1.4488 CC1OCCC1C(=O)NCCC(=O)N CSC061521274 [0,1,0,1,0,0|2,0,0]=4 249 B14R1.5469 CCOC1CC1C(=O)NCCC(=O)N CSC060217440 [0,1,0,1,0,0|2,0,0]=4 250 B14R1.5469 CCOC1CC1C(=O)NCCC(=O)O CSC012904880 [0,1,0,1,0,0|1,0,0]=3 251 B14R1.5888 CC1CC1CNC(=O)NCCC(=O)O CSC013429163 [0,1,0,1,0,0|1,0,0]=3 252 B14R1.10499 CCOCCNC(=O)C1CC1C(=O)O CSC011349485 [0,1,0,1,0,0|1,0,0]=3 253 B14R1.10499 COCCCNC(=O)C1CC1C(=O)O CSC011349433 [0,1,0,1,0,0|1,0,0]=3 254 B14R1.10499 CSCCCNC(=O)C1CC1C(=O)O CSC011957423 [0,1,0,1,0,0|1,0,0]=3 255 B14R1.808 CN(CCC(=O)O)C(=O)C1CCCO1 CSC011389146 [0,1,0,1,0,0|2,0,0]=4 256 B14R1.808 CN(CCC(=O)O)C(=O)C1CCOC1 CSC011441864 [0,1,0,1,0,0|2,0,0]=4 257 B14R1.729 COC(=O)CCNC(=O)C1CCCN1 CSC011197235 [0,1,0,1,0,0|2,0,0]=4 258 B14R1.729 COC(=O)CCNC(=O)C1CCCO1 CSC000159323 [0,1,0,1,0,0|2,0,0]=4 259 B14R1.729 COC(=O)CCNC(=O)C1CCCS1 CSC012019412 [0,1,0,1,0,0|2,0,0]=4 260 B14R1.729 COC(=O)CCNC(=O)C1CCNC1 CSC011791027 [0,1,0,1,0,0|2,0,0]=4 261 B14R1.729 COC(=O)CCNC(=O)C1CCOC1 CSC011448979 [0,1,0,1,0,0|2,0,0]=4 262 B14R1.729 COC(=O)CCNC(=O)[C@@H]1CCCN1 CSC011437936 [0,1,0,1,0,0|2,0,0]=4 263 B14R1.1025 COC(=O)CCCN1CCCC(C1)C CSC011293847 [0,1,0,1,0,0|2,0,0]=4 264 B14R1.1586 COC(=O)CCCN1CCCCCC1 CSC011293848 [0,1,0,1,0,0|2,0,0]=4 265 B14R1.2999 COC(=O)C1CC1C(=O)NCCCO CSC059886147 [0,1,0,1,0,0|2,0,0]=4 266 B14R1.2999 COCCNC(=O)C1CC1C(=O)OC CSC060296507 [0,1,0,1,0,0|2,0,0]=4 267 B14R1.19598 COC(=O)CNC1C(CCNC1=O)C CSC016327294 [0,1,0,1,0,0|2,0,0]=4 268 B14R1.5035 CC1CC(C1)NC(=O)NCCC(=O)O CSC013440500 [0,1,0,1,0,0|2,0,0]=4 269 B14R1.6365 C[C@@H](NC(=O)NCCC(=O)O)C1CC1 CSC056858594 [0,1,0,1,0,0|2,0,0]=4 270 B14R1.6365 C[C@H](NC(=O)NCCC(=O)O)C1CC1 CSC057304747 [0,1,0,1,0,0|2,0,0]=4 271 B14R1.10075 COC[C@@H](C)NC(=O)C1CC1C(=O)O CSC017176001 [0,1,0,1,0,0|2,0,0]=4 272 B14R1.10075 CSCC(C)NC(=O)C1CC1C(=O)O CSC012905014 [0,1,0,1,0,0|2,0,0]=4 273 B14R1.807 CC(CC(=O)O)CC(=O)N1CCCC1 CSC011778196 [0,1,0,1,0,0|1,0,0]=3 274 B14R1.807 CC(CC(=O)O)NC(=O)C1CCCO1 CSC000195650 [0,1,0,1,0,0|2,0,0]=4 275 B14R1.807 CC(CC(=O)O)NC(=O)C1CCOC1 CSC011441850 [0,1,0,1,0,0|2,0,0]=4 276 B14R1.421 CC(CNC(=O)C1CCCO1)C(=O)O CSC011724680 [0,1,0,1,0,0|2,0,0]=4 277 B14R1.421 CC(CNC(=O)C1CCOC1)C(=O)O CSC011724818 [0,1,0,1,0,0|2,0,0]=4 278 B14R1.4268 CC1CCC(O1)C(=O)NCCC(=O)N CSC061485474 [0,1,0,1,0,0|2,0,0]=4 279 B14R1.4268 CC1CCN(C1)C(=O)NCCC(=O)O CSC011434239 [0,1,0,1,0,0|2,0,0]=4 280 B14R1.13599 COCCN(C)C(=O)C1CC1C(=O)O CSC011402386 [0,1,0,1,0,0|2,0,0]=4 281 B14R1.16497 NC(=O)CCNC(=O)C1(CCCC1)O CSC060665482 [0,1,0,1,0,0|2,0,0]=4 282 B14R1.6383 CC1(CC1)CNC(=O)NCCC(=O)O CSC014390448 [0,1,0,1,0,0|2,0,0]=4 283 B14R1.13574 COC(C)CNC(=O)C1CC1C(=O)O CSC013875855 [0,1,0,1,0,0|2,0,0]=4 284 B14R1.13574 CSC(C)CNC(=O)C1CC1C(=O)O CSC013437515 [0,1,0,1,0,0|2,0,0]=4 285 B14R1.6350 OC(=O)CCNS(=O)(=O)CC1CCC1 CSC018635914 [0,1,0,1,0,0|2,0,0]=4 286 B14R1.6351 OC(=O)CCNS(=O)(=O)CCC1CC1 CSC013682332 [0,1,0,1,0,0|2,0,0]=4 287 B14R1.16503 CC1(CC1NC(=O)NCCC(=O)O)C CSC011568821 [0,1,0,1,0,0|2,0,0]=4 288 B14R2.9415 OC(=O)C1CC1C(=O)N2CCCC2 CSC011349246 [0,0,0,2,0,0|1,0,0]=3 289 B10R0.78 CCCCC(=O)NCC(=O)O CSC000205572 [1,0,0,0,1,0|1,0,0]=3 290 B14R0.231 CCCCCC(=O)NCCCCC(=O)O CSC011593324 [0,0,0,0,0,2|0,0,0]=2 291 B14R0.231 CCCCCC(=O)NCCOCC(=O)O CSC012580475 [0,0,0,0,0,2|0,0,0]=2 292 B14R0.231 CCCCCC(=O)NCCSCC(=O)O CSC012905702 [0,0,0,0,0,2|0,0,0]=2 293 B14R0.231 CCCOCC(=O)NCCCCC(=O)O CSC012905564 [0,0,0,0,0,2|1,0,0]=3 294 B14R0.231 CCCOCC(=O)NCCSCC(=O)O CSC012905715 [0,0,0,0,0,2|1,0,0]=3 295 B14R0.231 CCCSCC(=O)NCCCCC(=O)O CSC012905562 [0,0,0,0,0,2|1,0,0]=3 296 B14R0.231 CCCSCC(=O)NCCOCC(=O)O CSC057378245 [0,0,0,0,0,2|1,0,0]=3 297 B14R0.231 CCCSCC(=O)NCCSCC(=O)O CSC012905708 [0,0,0,0,0,2|1,0,0]=3 298 B14R0.231 CCOCCC(=O)NCCCCC(=O)O CSC011973628 [0,0,0,0,0,2|1,0,0]=3 299 B14R0.231 COCCCC(=O)NCCCCC(=O)O CSC011593344 [0,0,0,0,0,2|1,0,0]=3 300 B14R0.231 COCCCC(=O)NCCSCC(=O)O CSC012905721 [0,0,0,0,0,2|1,0,0]=3