0 B13R0.280 CCCCCCCCCCP(=O)(C)C Z57683826 [0,0,0,0,0,0|3,0,0]=3 1 B12R0.234 C=CCCCCCCCCC(=O)O Z104479700 [1,0,0,0,0,0|1,0,2]=4 2 B12R0.234 CCCCCCCCCCC(=O)O Z104473988 [1,0,0,0,0,0|1,0,0]=2 3 B12R0.234 CCCCCCCCOCC(=O)O Z362795602 [1,0,0,0,0,0|2,0,0]=3 4 B12R0.234 O=C(O)CCCCCCCCCO Z1255434772 [1,0,0,0,0,0|2,0,0]=3 5 B14R1.847 CS(=O)(=O)NC1CCCCCC1CO Z1530168531 [0,0,0,1,0,0|3,0,0]=4 6 B14R1.3131 CS(=O)(=O)CCCN1CCCC1CO Z1097110210 [0,0,0,1,0,0|3,0,0]=4 7 B14R1.3331 CS(=O)(=O)NCCCN1CCCCC1 Z133778732 [0,0,0,1,0,0|3,0,0]=4 8 B14R1.3333 CS(=O)(=O)CCCONC1CCCC1 Z1621674999 [0,0,0,1,0,0|3,0,0]=4 9 B14R1.4972 O=S1(=O)CCNCCCCCCCN1 Z3067528051 [0,0,0,1,0,0|2,0,0]=3 10 B11R0.148 CCCCCCCCCC(=O)O Z104474944 [2,0,0,0,0,0|1,0,0]=3 11 B11R0.148 CCCCCCCNCC(=O)O Z1259273296 [2,0,0,0,0,0|2,0,0]=4 12 B11R0.3 CCCCCCCCCCC=O Z993017862 [2,0,0,0,0,0|1,0,0]=3 13 B11R0.3 CCCCCCCCCCNC Z102767086 [2,0,0,0,0,0|2,0,0]=4 14 B11R0.3 CCCCCCCCSCCO Z425753146 [2,0,0,0,0,0|2,0,0]=4 15 B11R0.3 CCCCCCCNCCCO Z139305228 [2,0,0,0,0,0|2,0,0]=4 16 B13R0.54 CCCCCCCCC/C=C/C(=O)O Z336127680 [1,1,0,0,0,0|1,0,1]=4 17 B13R0.54 CCCCCCCCCCCC(=O)O Z104476194 [1,1,0,0,0,0|1,0,0]=3 18 B13R0.54 O=C(O)CCCCCCCCCCBr Z57953031 [1,1,0,0,0,0|1,0,0]=3 19 B13R0.147 COC(=O)CCCCCCCCCN Z3221366174 [1,1,0,0,0,0|2,0,0]=4 20 B13R0.150 CCCCCCCCCC(O)C(=O)O Z1269030530 [1,1,0,0,0,0|1,0,0]=3 21 B13R0.335 CCCCCCCCC(C)CC(=O)O Z1269116031 [1,1,0,0,0,0|1,0,0]=3 22 B15R0.1157 CCCCCCCCCNS(=O)(=O)CCC Z815150044 [0,2,0,0,0,0|2,0,0]=4 23 B13R1.612 CO[C@@H]1CCCCC[C@@H]1S(=O)(=O)F Z3333540688 [1,0,0,1,0,0|2,0,0]=4 24 B13R1.622 CCC1CCCCC1NS(=O)(=O)C Z401483532 [1,0,0,1,0,0|2,0,0]=4 25 B13R1.2904 CS(=O)(=O)NCCCC1CCCC1 Z319888734 [1,0,0,1,0,0|2,0,0]=4 26 B13R1.2904 O=S(=O)(F)CCOCC1CCCC1 Z2907448719 [1,0,0,1,0,0|2,0,0]=4 27 B13R1.3523 NS(=O)(=O)CCOC1CCCCC1 Z1206904517 [1,0,0,1,0,0|2,0,0]=4 28 B13R1.6279 CS(=O)(=O)NC1CCCCCCC1 Z53825507 [1,0,0,1,0,0|2,0,0]=4 29 B13R1.27 CCCCCCCC1CCC(=O)O1 Z90120148 [1,0,0,1,0,0|1,0,0]=3 30 B13R1.90 CCC1CCCCC1OCC(=O)O Z316259164 [1,0,0,1,0,0|2,0,0]=4 31 B13R1.167 NC1CCCC1CCCCC(=O)O Z5386737761 [1,0,0,1,0,0|2,0,0]=4 32 B13R1.279 O=C1CCCCCCCCCCC1 Z104473098 [1,0,0,1,0,0|2,0,0]=4 33 B13R1.337 O=C(O)CCCCN1CCCCC1 Z1270387209 [1,0,0,1,0,0|2,0,0]=4 34 B13R1.572 CCCCN1CCCCC1C(=O)O Z1665192314 [1,0,0,1,0,0|2,0,0]=4 35 B13R1.659 CCCCCCCCCCC1CO1 Z1255485282 [1,0,0,1,0,0|2,0,0]=4 36 B15R1.362 CC1CCCCC1OCCNS(=O)(=O)C Z416437818 [0,1,0,1,0,0|2,0,0]=4 37 B15R1.362 CC1CCCCN1CCCNS(=O)(=O)C Z414531086 [0,1,0,1,0,0|2,0,0]=4 38 B15R1.3890 CS(=O)(=O)CCSCCN1CCCCC1 Z1449297761 [0,1,0,1,0,0|2,0,0]=4 39 B15R1.3890 CS(=O)(=O)NCCCOC1CCCCC1 Z133866314 [0,1,0,1,0,0|2,0,0]=4 40 B15R1.3890 CS(=O)(=O)NCCSCC1CCCCC1 Z1147677001 [0,1,0,1,0,0|2,0,0]=4 41 B15R1.6598 CN1CCCC1CCSCCS(=O)(=O)C Z1526866963 [0,1,0,1,0,0|2,0,0]=4 42 B15R1.16600 CS(=O)(=O)CCSCC1CCCCCC1 Z1675255641 [0,1,0,1,0,0|1,0,0]=3 43 B15R1.16600 CS(=O)(=O)NCCOC1CCCCCC1 Z1228551093 [0,1,0,1,0,0|2,0,0]=4 44 B15R1.16600 O=S(=O)(O)CCCCN1CCCCCC1 Z123644776 [0,1,0,1,0,0|0,0,0]=2 45 B15R1.16614 NS(=O)(=O)CCCN1CCCCCCC1 Z1082815974 [0,1,0,1,0,0|1,0,0]=3 46 B15R1.19902 CCC1CCCN1CCCS(=O)(=O)NC Z1176353966 [0,1,0,1,0,0|2,0,0]=4 47 B15R1.8962 CC(C)CCCNCC1CCS(=O)(=O)C1 Z1537574167 [0,1,0,1,0,0|2,0,0]=4 48 B15R2.4441 NS(=O)(=O)N1CCC2CCCCC2C1 Z300315734 [0,0,0,2,0,0|2,0,0]=4 49 B15R2.4441 O=S(=O)(F)N1CCC2CCCCC2C1 Z3466011332 [0,0,0,2,0,0|2,0,0]=4 50 B15R2.109477 NS(=O)(=O)N1CCC[C@H]2[C@@H]1CCCC2 Z1792685795 [0,0,0,2,0,0|2,0,0]=4 51 B15R2.109477 O=S(=O)(F)N1CCCC2C1CCCC2 Z3466011326 [0,0,0,2,0,0|2,0,0]=4 52 B15R2.4424 CS(=O)(=O)N1CCCC1C2CCCC2 Z741994126 [0,0,0,2,0,0|2,0,0]=4 53 B15R2.4444 CS(=O)(=O)NC1CC1C2CCCCC2 Z1271280569 [0,0,0,2,0,0|2,0,0]=4 54 B15R2.7532 O=S1(=O)CCC(C1)NC2CCCCC2 Z56988269 [0,0,0,2,0,0|2,0,0]=4