0 B13R1.133 CC(=O)C(=O)CN1CCC(CC1)O 269982a_100025773856_100011261029 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.133 NC(=O)C(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100011215815 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.43 C[C@H](NC1C=CCCC1)C(=O)O 269956a_100000743915_100000751183 [1,0,0,0,0,0|2,0,1]=4 3 B14R1.134 COC(=O)C(=O)N[C@H]1CC[C@H](CC1)O 1626a_100020628982_100000024059 [0,1,0,0,0,0|1,0,2]=4 4 B14R1.134 COC(=O)C(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100000024059 [0,1,0,0,0,0|1,0,2]=4 5 B12R1.104 CC(=O)C(=O)CN1CCC(C1)O 269982a_100011215560_100011261029 [0,0,0,0,1,0|2,0,1]=4 6 B12R1.104 NC(=O)C(=O)N[C@H]1CC[C@H](C1)O 240690a_100015195300_100011215815 [0,0,0,0,1,0|2,0,1]=4 7 B14R1.698 NC(=O)CC(=O)CC1CCC(CC1)O 1458a_100012184027_100000187820 [0,0,0,0,0,1|1,0,2]=4 8 B14R1.698 O=C([O-])CC(=O)CC1CCC(CC1)O 1458a_100012184027_100020667443 [0,0,0,0,0,1|0,0,3]=4 9 B11R0.42 C=CCCCCCC(=O)C(=C)C 1458a_100000185857_100000700193 [1,0,1,0,0,0|2,0,0]=4 10 B11R0.42 C=CCCCCCC(=O)C(O)O 1458a_100000233687_100000700193 [1,0,1,0,0,0|0,0,2]=4 11 B11R0.42 C=CCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000700193 [1,0,1,0,0,0|1,0,1]=4 12 B11R0.42 C=CCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000700193 [1,0,1,0,0,0|1,0,1]=4 13 B11R0.42 C=CCCCCNC(=O)C(=O)N 240690a_100000703577_100011215815 [1,0,1,0,0,0|2,0,0]=4 14 B11R0.42 C=CCCCNCC(=O)C(=O)C 34a_100000700776_100011261029 [1,0,1,0,0,0|2,0,0]=4 15 B11R0.42 C=CCCCOCC(=O)C(=O)C 34a_100000758997_100011261029 [1,0,1,0,0,0|2,0,0]=4 16 B11R0.42 C=CCCCSCC(=O)C(=O)C 62a_100011261029_100000757094 [1,0,1,0,0,0|2,0,0]=4 17 B11R0.42 C=CCCCSCC(=O)C(=O)C 62a_100011713584_100011261029 [1,0,1,0,0,0|2,0,0]=4 18 B11R1.91 O=C(O)CNC1C=CCCC1 269956a_100016091260_100000751183 [2,0,0,0,0,0|1,0,1]=4 19 B13R1.59 NC(=O)C(=O)N[C@H]1C=C[C@H](C1)CO 240690a_100020646542_100011215815 [0,1,0,0,1,0|2,0,0]=4 20 B13R1.134 COC(=O)C(=O)N[C@H]1CC[C@H](C1)O 1626a_100015195300_100000024059 [0,1,0,0,1,0|1,0,1]=4 21 B13R1.134 COC(=O)C(=O)N[C@H]1CC[C@H](C1)O 240690a_100015195300_100000024059 [0,1,0,0,1,0|1,0,1]=4 22 B15R1.981 COC(=O)CC(=O)CC1CCC(CC1)O 1458a_100012184027_100000747449 [0,1,0,0,0,1|0,0,2]=4 23 B11R0.109 C=CC(O)CSCC(=O)C(=O)C 62a_100000730141_100011261029 [0,0,1,0,1,0|2,0,0]=4 24 B11R0.109 C=CC(O)CSCC(=O)C(=O)C 62a_100011261029_100000730141 [0,0,1,0,1,0|2,0,0]=4 25 B11R1.36 C=C(C)C(=O)C1C=CCCC1 1458a_100000185857_100000751183 [1,0,0,0,1,0|2,0,0]=4 26 B11R1.36 C[C@@H](O)C(=O)C1C=CCCC1 1458a_100000717761_100000751183 [1,0,0,0,1,0|1,0,1]=4 27 B11R1.36 C[C@H](O)C(=O)C1C=CCCC1 1458a_217856618621_100000751183 [1,0,0,0,1,0|1,0,1]=4 28 B11R1.36 O=C(C(O)O)C1C=CCCC1 1458a_100000233687_100000751183 [1,0,0,0,1,0|0,0,2]=4 29 B13R0.198 C=CC(O)CSCCC(=O)NC(=O)N 62a_100000730141_100000237605 [0,0,1,0,0,1|2,0,0]=4 30 B13R0.1188 C=CC(CCCC)OCC(=O)C(=O)C 34a_200011215037_100011261029 [0,0,1,0,0,1|2,0,0]=4 31 B13R1.351 CC(=O)C(=O)COC1C=CCCC1 34a_100011215024_100011261029 [1,0,0,0,0,1|1,0,0]=3 32 B13R1.351 CC(=O)C(=O)CSC1C=CCCC1 62a_100000751183_100011261029 [1,0,0,0,0,1|1,0,0]=3 33 B13R1.351 CC(=O)C(=O)CSC1C=CCCC1 62a_100011261029_100000751183 [1,0,0,0,0,1|1,0,0]=3 34 B13R1.351 CC(CNC1C=CCCC1)C(=O)O 269956a_100000749485_100000751183 [1,0,0,0,0,1|1,0,1]=4 35 B13R1.351 O=C(O)C(F)CNC1C=CCCC1 269956a_100000084737_100000751183 [1,0,0,0,0,1|1,0,1]=4