0 B12R2.5234 CC1(C)OC2(C)CCC1C=C2 HMDB0036085 [0,0,0,0,0,0|0,0,2]=2 1 B11R1.19 CC(C)(O)C1CCC(=C)CC1 HMDB0036991 [0,0,1,0,0,0|0,0,2]=3 2 B11R1.19 CC1=CCC(CC1)C(C)(C)S HMDB0035703 [0,0,1,0,0,0|0,1,2]=4 3 B11R1.19 CC1=CC[C@@H](CC1)C(C)(C)O HMDB0036086 [0,0,1,0,0,0|0,0,2]=3 4 B11R1.19 CC1CCC(CC1)C(C)(C)O HMDB0034717 [0,0,1,0,0,0|0,0,0]=1 5 B11R1.727 CC(=C)C1CCC(C)(O)CC1 HMDB0036996 [0,0,1,0,0,0|0,0,2]=3 6 B11R1.727 CC(=C)[C@H]1CC[C@@](C)(O)CC1 HMDB0037215 [0,0,1,0,0,0|0,0,2]=3 7 B11R1.727 CC(=C)[C@H]1CC[C@](C)(O)CC1 HMDB0037214 [0,0,1,0,0,0|0,0,2]=3 8 B11R1.727 CC(C)=C1CCC(C)(O)CC1 HMDB0036993 [0,0,1,0,0,0|0,0,2]=3 9 B11R1.727 CC(C)C1=CCC(C)(O)CC1 HMDB0038025 [0,0,1,0,0,0|0,0,2]=3 10 B11R1.727 CC(C)C1CCC(C)(O)CC1 HMDB0037020 [0,0,1,0,0,0|0,0,0]=1 11 B11R1.1072 CC1(C)CCCC(C)(O1)C=C HMDB0037133 [0,0,1,0,0,0|0,0,2]=3 12 B10R1.13 CC(C)C1=CCC(C)CC1 HMDB0037213 [1,0,1,0,0,0|0,0,2]=4 13 B10R1.13 CC(C)C1CCC(C)CC1 HMDB0031455 [1,0,1,0,0,0|0,0,0]=2 14 B10R1.18 CC(=O)OC1CCCCC1 HMDB0031352 [1,0,1,0,0,0|1,0,1]=4 15 B12R1.126 CC1CCC(C(=O)C1)C(C)(C)S HMDB0037385 [0,1,1,0,0,0|0,1,1]=4 16 B12R1.126 CC1CCC(C(O)C1)C(C)(C)O HMDB0036145 [0,1,1,0,0,0|0,0,0]=2 17 B12R1.976 CC(C)(O)C1CCC(C)(O)CC1 HMDB0035595 [0,1,1,0,0,0|0,0,0]=2 18 B12R1.3966 CC1(C)OC(C)(CCC1O)C=C HMDB0035365 [0,1,1,0,0,0|1,0,1]=4 19 B12R1.3966 CC1(C)O[C@@](C)(CC[C@H]1O)C=C HMDB0031440 [0,1,1,0,0,0|1,0,1]=4 20 B12R1.3966 CC1(C)O[C@](C)(CC[C@H]1O)C=C HMDB0031441 [0,1,1,0,0,0|1,0,1]=4 21 B12R1.3966 CC1(C)O[C@](C)(CC[C@H]1O)C=C HMDB0041630 [0,1,1,0,0,0|1,0,1]=4 22 B12R1.829 CC(C)C1CCC(C)(O)CC1O HMDB0037387 [0,1,1,0,0,0|0,0,0]=2 23 B12R1.829 CC(C)C1CCC(C)(S)CC1=O HMDB0032205 [0,1,1,0,0,0|0,1,1]=4 24 B12R1.3088 CC(C)C1(O)CCC(C)(O)C=C1 HMDB0037021 [0,1,1,0,0,0|0,0,2]=4 25 B12R2.509 CC1(C)C2CCC(C)(C2)C1=O HMDB0034985 [0,1,0,0,1,0|1,0,0]=3 26 B12R2.509 CC1(C)C2CCC(C)(C2)C1O HMDB0034932 [0,1,0,0,1,0|1,0,0]=3 27 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)C2 HMDB0035815 [0,1,0,0,1,0|0,0,0]=2 28 B12R2.2786 CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)C2 HMDB0035819 [0,1,0,0,1,0|0,0,0]=2 29 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)[C@H](O)C2 HMDB0034976 [0,1,0,0,1,0|0,0,0]=2 30 B12R2.2786 CC1(C)[C@H]2CC[C@]1(C)[C@H](O)C2 HMDB0035818 [0,1,0,0,1,0|0,0,0]=2 31 B14R2.9028 CC1(C)OC2(C)CC(O)C1CC2O HMDB0033010 [0,2,0,0,0,0|0,0,0]=2 32 B14R2.13406 CC1(C)OC2(C)C(O)CC1CC2O HMDB0041376 [0,2,0,0,0,0|0,0,0]=2 33 B14R2.28201 CC1(C)OC2(C)CCC1(O)CC2O HMDB0041545 [0,2,0,0,0,0|0,0,0]=2 34 B10R0.6 CCCCCC(=O)OC(C)C HMDB0040430 [0,0,2,0,0,0|1,0,1]=4 35 B10R0.65 CCC(C)(O)CCCC(C)C HMDB0035246 [0,0,2,0,0,0|0,0,0]=2 36 B12R2.598 CC1=CCC2CC1OC2(C)C HMDB0038251 [0,0,1,1,0,0|0,0,2]=4 37 B12R2.598 CC1C=CC2CC1OC2(C)C HMDB0037008 [0,0,1,1,0,0|0,0,2]=4 38 B12R2.598 CC1CCC2CC1OC2(C)C HMDB0037019 [0,0,1,1,0,0|0,0,0]=2 39 B12R2.598 CC1CCC2CC1SC2(C)C HMDB0032251 [0,0,1,1,0,0|0,1,0]=3 40 B12R2.1182 CC1=CCC2(CC1)OC2(C)C HMDB0037009 [0,0,1,1,0,0|0,0,2]=4 41 B12R2.5294 CC1(C)C2CC1C(C)(S)CC2 HMDB0032377 [0,0,1,1,0,0|2,0,0]=4 42 B12R2.3180 CC(=C)C1CCC2(C)OC2C1 HMDB0035158 [0,0,1,1,0,0|0,0,2]=4 43 B12R2.5613 CC1(C)C2CCC(C)(O)CC12 HMDB0035954 [0,0,1,1,0,0|0,0,0]=2 44 B12R2.6448 CC(C)C12CCC(C)(CC1)O2 HMDB0036096 [0,0,1,1,0,0|0,0,0]=2 45 B12R2.6452 CC(C)C12CC1C(C)(O)C=C2 HMDB0034916 [0,0,1,1,0,0|0,0,2]=4 46 B12R2.6452 CC(C)[C@@]12C[C@H]1[C@@](C)(O)CC2 HMDB0036112 [0,0,1,1,0,0|0,0,0]=2 47 B12R3.4045 CC12C3CC(CC13)C2(C)C HMDB0038121 [0,0,0,1,1,0|0,0,0]=2