0 B13R0.54 C(CCCCCS)CCCCC(=O)O MDX [0,0,0,0,0,0|1,0,0]=1 1 B13R0.54 CC(=O)CCCCCCCCCC=C 2TD [0,0,0,0,0,0|1,0,2]=3 2 B13R0.54 CCCCCCCCCCCC(=O)O DAO [0,0,0,0,0,0|0,0,0]=0 3 B13R0.54 CCCCCCCCCCCC(=O)O LAU [0,0,0,0,0,0|0,0,0]=0 4 B13R0.54 CCCCCCCCCCOC(=O)S UDT [0,0,0,0,0,0|1,1,0]=2 5 B13R0.54 CCCCCCCCC\C=C\C(=O)O 3X1 [0,0,0,0,0,0|0,0,2]=2 6 B13R0.54 CCCCCCC\C=C\C=C\C(=O)O MH9 [0,0,0,0,0,0|0,0,4]=4 7 B12R0.5 CCCCCCCCCCCCC TRD [1,0,0,0,0,0|1,0,1]=3 8 B12R0.5 CCCCCCCCCCCCO 1DO [1,0,0,0,0,0|0,0,1]=2 9 B12R0.5 CCCCCCCCCCOC=O DFD [1,0,0,0,0,0|1,0,0]=2 10 B12R0.5 CCCCCCCCCCOCO DEM [1,0,0,0,0,0|1,0,1]=3 11 B12R0.234 CCCCCCCCCCC(=O)O 11A [1,0,0,0,0,0|0,0,0]=1 12 B14R0.88 CCCCCCCCCCC[N+](C)(C)[O-] DET [0,1,0,0,0,0|2,0,1]=4 13 B14R0.88 CCCCCCCCCCOS(=O)(=O)N O48 [0,1,0,0,0,0|2,0,1]=4 14 B14R0.337 CCCCCCCCCCC[P@@H](=O)OC DPE [0,1,0,0,0,0|1,0,0]=2 15 B14R0.340 C(CCNCCCCN)C[C@@H](C(=O)O)N 5GG [0,1,0,0,0,0|2,0,0]=3 16 B14R0.391 CCCCCCCCCC(=O)CC(=O)O 3LA [0,1,0,0,0,0|0,0,1]=2 17 B14R0.391 CCCCCCCCC[C@H](CC(=O)O)O HXD [0,1,0,0,0,0|0,0,0]=1 18 B14R0.394 C(CCCCCC(=O)O)CCCCCBr BRC [0,1,0,0,0,0|0,0,0]=1 19 B14R0.394 C(CCCCCC(=O)O)CCCCCN DOA [0,1,0,0,0,0|0,0,0]=1 20 B14R0.394 C(CCCCCC(=O)O)CCCCCO 12H [0,1,0,0,0,0|0,0,0]=1 21 B14R0.394 CCCCCCCCCCCCC(=O)O TDA [0,1,0,0,0,0|0,0,0]=1 22 B11R0.3 C(CCCCO)CCCNCO HHO [2,0,0,0,0,0|2,0,0]=4 23 B11R0.3 CCCCCCCCCCC=O UNA [2,0,0,0,0,0|0,0,0]=2 24 B11R0.3 CCCCCCCCCCCC D12 [2,0,0,0,0,0|0,0,1]=3 25 B11R0.148 CCCCCCCCCC(=O)C UOC [2,0,0,0,0,0|1,0,0]=3 26 B11R0.148 CCCCCCCCCC(=O)O CRC [2,0,0,0,0,0|0,0,0]=2 27 B11R0.148 CCCCCCCCCC(=O)O DKA [2,0,0,0,0,0|0,0,0]=2 28 B13R0.336 C(CCCCCCBr)CCCCCO BDD [1,1,0,0,0,0|0,0,1]=3 29 B13R0.336 C(CCCCCCN)CCCCCN 297 [1,1,0,0,0,0|1,0,1]=4 30 B13R0.336 CCCCCCCCCCCCC=S 3LX [1,1,0,0,0,0|0,1,0]=3 31 B13R0.336 CCCCCCCCCCCCCC C14 [1,1,0,0,0,0|1,0,1]=4 32 B13R0.179 C(CCCCC(=O)O)CCCC(=O)O DEC [1,1,0,0,0,0|1,0,1]=4 33 B13R0.179 CC(C)CCCCCCCCC(=O)O M12 [1,1,0,0,0,0|0,0,0]=2 34 B13R0.280 CCCCCCCCCCP(=O)(C)C DCX [1,1,0,0,0,0|2,0,0]=4 35 B13R0.280 CCCCCCCCCCS(=O)(=O)O 1DB [1,1,0,0,0,0|1,0,0]=3 36 B15R0.2702 CC(C)CCCNCCCC[C@@H](C(=O)O)N LYU [0,2,0,0,0,0|1,0,0]=3 37 B15R0.252 CCCCCCCCCCCCS(=O)(=O)[O-] DSC [0,2,0,0,0,0|1,0,1]=4 38 B15R0.254 CCCCCCCCCCC[P@](=O)(O)OC MUP [0,2,0,0,0,0|1,0,0]=3 39 B15R0.84 CCCCCCCCCSC[C@@H](C(=O)O)N GT9 [0,2,0,0,0,0|0,0,0]=2 40 B15R0.366 CCCCCCCCCCC[C@H](CC=O)O BFC [0,2,0,0,0,0|0,0,1]=3 41 B15R0.3221 CCCCCCCCC[C@@H](CC(=O)OC)O DK3 [0,2,0,0,0,0|0,0,0]=2 42 B15R0.386 C(CCNC[C@H](CCN)O)C[C@@H](C(=O)O)N 5CT [0,2,0,0,0,0|2,0,0]=4 43 B15R0.164 B(CCCCCCCCCCCCC)(O)O B0S [0,2,0,0,0,0|1,0,1]=4 44 B15R0.164 CCCCCCCCCCCCCC(=O)O MYR [0,2,0,0,0,0|0,0,0]=2 45 B15R0.164 CCCC\C=C/CCCCCCCC(=O)O MYZ [0,2,0,0,0,0|0,0,0]=2 46 B15R0.222 CC(C)CCCCCCC\C=C/CC(=O)O LNG [0,2,0,0,0,0|0,0,1]=3 47 B13R1.1022 C1CCCC(CCC1)NCC(=O)O CNG [1,0,0,1,0,0|1,0,0]=3 48 B15R1.253 C1CCCCCNC(=O)[C@H](CCCC1)N RIN [0,1,0,1,0,0|1,0,0]=3 49 B15R1.3664 C1CCN(CC1)CCCC[C@@H](C(=O)O)N LP6 [0,1,0,1,0,0|1,0,0]=3 50 B15R1.11891 CCCCCCCCC[C@H]1C[C@@H]1C(=O)O Y39 [0,1,0,1,0,0|0,0,0]=2 51 B15R2.984 C[N@@]1C[C@H]2CCCC[C@H]2C[C@H]1C(=O)O DIQ [0,0,0,2,0,0|1,0,0]=3