0 B6R0.1 CC(CC=C)C=O HMDB0030332 [0,0,0,0,0,0|0,0,2]=2 1 B6R0.1 CC/C=C(/C)C=O HMDB0033714 [0,0,0,0,0,0|0,0,2]=2 2 B6R0.1 CCCC(=O)CC HMDB0000753 [0,0,0,0,0,0|2,0,2]=4 3 B6R0.1 CCCC(=O)OC HMDB0033890 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.1 CCCC(=O)SC HMDB0031191 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.1 CCCC(C)C=O HMDB0031578 [0,0,0,0,0,0|0,0,0]=0 6 B6R0.1 CCCC(O)C=C HMDB0031503 [0,0,0,0,0,0|2,0,0]=2 7 B6R0.1 CCCC(O)CC HMDB0031493 [0,0,0,0,0,0|2,0,1]=3 8 B6R0.1 CCOC(C)CC HMDB0031326 [0,0,0,0,0,0|2,0,1]=3 9 B6R0.1 CSC/C(C)=C/C HMDB0032411 [0,0,0,0,0,0|2,0,1]=3 10 B6R0.1 OC(CC#N)C=C HMDB0031339 [0,0,0,0,0,0|3,0,1]=4 11 B5R0.1 C/C=C/C(C)=O HMDB0001184 [1,0,0,0,0,0|0,0,3]=4 12 B5R0.1 CC(=C)CCO HMDB0030126 [1,0,0,0,0,0|1,0,1]=3 13 B5R0.1 CC(=O)CC=C HMDB0031606 [1,0,0,0,0,0|0,0,3]=4 14 B5R0.1 CC(C)CCN HMDB0031659 [1,0,0,0,0,0|1,0,1]=3 15 B5R0.1 CC(C)CCO HMDB0006007 [1,0,0,0,0,0|1,0,1]=3 16 B5R0.1 CC(O)CCO HMDB0031320 [1,0,0,0,0,0|1,0,1]=3 17 B5R0.1 CCCC(O)=O HMDB0000039 [1,0,0,0,0,0|1,0,1]=3 18 B5R0.1 CCNC(C)=O HMDB0031215 [1,0,0,0,0,0|1,0,1]=3 19 B5R0.1 CCOC(C)=O HMDB0031217 [1,0,0,0,0,0|1,0,1]=3 20 B5R0.1 CCOC(N)=O HMDB0031219 [1,0,0,0,0,0|2,0,1]=4 21 B5R0.1 CCOC(O)=O HMDB0031232 [1,0,0,0,0,0|2,0,1]=4 22 B5R0.1 CCSC(C)=O HMDB0031190 [1,0,0,0,0,0|1,0,1]=3 23 B5R0.1 CN(C)CCO HMDB0032231 [1,0,0,0,0,0|2,0,1]=4 24 B5R0.1 CNCC(O)=O HMDB0000271 [1,0,0,0,0,0|2,0,1]=4 25 B5R0.1 COCC(O)=O HMDB0041929 [1,0,0,0,0,0|2,0,1]=4 26 B5R0.1 NCCC(O)=O HMDB0000056 [1,0,0,0,0,0|2,0,1]=4 27 B5R0.1 NCCS(O)=O HMDB0000965 [1,0,0,0,0,0|3,0,0]=4 28 B5R0.1 OC(=O)CCI HMDB0031252 [1,0,0,0,0,0|2,0,1]=4 29 B5R0.1 OCCC(O)=O HMDB0000700 [1,0,0,0,0,0|2,0,1]=4 30 B5R0.2 C=CCCC=O HMDB0032458 [1,0,0,0,0,0|0,0,2]=3 31 B5R0.2 CC/C=C\C=O HMDB0031601 [1,0,0,0,0,0|0,0,2]=3 32 B5R0.2 CCCCC=O HMDB0031206 [1,0,0,0,0,0|0,0,0]=1 33 B5R0.2 CCCCCC HMDB0029600 [1,0,0,0,0,0|1,0,1]=3 34 B5R0.2 CCCCCO HMDB0013036 [1,0,0,0,0,0|0,0,2]=3 35 B5R0.2 CCCCCS HMDB0032457 [1,0,0,0,0,0|0,1,1]=3 36 B5R0.2 CCCSSC HMDB0031872 [1,0,0,0,0,0|3,0,0]=4 37 B5R0.2 CCOCCO HMDB0031213 [1,0,0,0,0,0|1,0,2]=4 38 B5R0.2 CSCCC=O HMDB0031857 [1,0,0,0,0,0|1,0,0]=2 39 B5R0.2 CSCCCO HMDB0031716 [1,0,0,0,0,0|1,0,2]=4 40 B5R0.2 CSCCSC HMDB0031708 [1,0,0,0,0,0|3,0,0]=4 41 B5R0.2 C[Se]SCC=C HMDB0030877 [1,0,0,0,0,0|3,0,0]=4 42 B5R0.2 NCCCC=O HMDB0001080 [1,0,0,0,0,0|1,0,0]=2 43 B5R0.2 NCCCCN HMDB0001414 [1,0,0,0,0,0|2,0,1]=4 44 B5R0.3 C/C=C(/C)C=O HMDB0031512 [1,0,0,0,0,0|0,0,2]=3 45 B5R0.3 CCC(=O)C=C HMDB0031607 [1,0,0,0,0,0|2,0,1]=4 46 B5R0.3 CCC(C)C=O HMDB0031526 [1,0,0,0,0,0|0,0,0]=1 47 B5R0.3 CCC(C)CN HMDB0032392 [1,0,0,0,0,0|1,0,1]=3 48 B5R0.3 CCC(C)CO HMDB0031527 [1,0,0,0,0,0|0,0,2]=3 49 B5R0.3 CCC(O)C=C HMDB0031605 [1,0,0,0,0,0|2,0,0]=3 50 B5R0.3 CC[C@H](C)C=O HMDB0031525 [1,0,0,0,0,0|0,0,0]=1 51 B5R0.3 COC(C)OC HMDB0030061 [1,0,0,0,0,0|3,0,0]=4 52 B5R0.3 OCC(O)C=O HMDB0001051 [1,0,0,0,0,0|2,0,0]=3 53 B7R0.2 CSC(C)CC(C)=O HMDB0032430 [0,1,0,0,0,0|2,0,1]=4 54 B7R0.3 CCCCC(C)CC HMDB0031583 [0,1,0,0,0,0|1,0,1]=3 55 B7R0.5 C/C=C\C(C)C(O)=O HMDB0031562 [0,1,0,0,0,0|0,0,2]=3 56 B7R0.5 CC(CC=C)C(O)=O HMDB0031158 [0,1,0,0,0,0|0,0,2]=3 57 B7R0.5 CC/C=C(/C)C(O)=O HMDB0031560 [0,1,0,0,0,0|0,0,2]=3 58 B7R0.5 CCCC(=O)C(C)=O HMDB0031491 [0,1,0,0,0,0|1,0,1]=3 59 B7R0.5 CCCC(=O)C(O)=O HMDB0001865 [0,1,0,0,0,0|1,0,1]=3 60 B7R0.5 CCCC(C)C(O)=O HMDB0031580 [0,1,0,0,0,0|0,0,0]=1 61 B7R0.5 CCCC(O)C(O)=O HMDB0001863 [0,1,0,0,0,0|1,0,0]=2 62 B7R0.5 CCC[C@@H](N)C(O)=O HMDB0013716 [0,1,0,0,0,0|1,0,0]=2 63 B7R0.5 C[Se]CC(N)C(O)=O HMDB0031466 [0,1,0,0,0,0|2,0,0]=3 64 B7R0.5 C[Se]C[C@H](N)C(O)=O HMDB0004113 [0,1,0,0,0,0|2,0,0]=3 65 B7R0.5 NC(CCS)C(O)=O HMDB0000742 [0,1,0,0,0,0|2,0,0]=3 66 B7R0.5 NC(CC[SeH])C(O)=O HMDB0004119 [0,1,0,0,0,0|2,0,0]=3 67 B7R0.5 NCCC(=C)C(O)=O HMDB0030409 [0,1,0,0,0,0|1,0,2]=4 68 B7R0.5 NCC[C@H](N)C(O)=O HMDB0006284 [0,1,0,0,0,0|2,0,0]=3 69 B7R0.5 N[C@@H](CC=O)C(O)=O HMDB0012249 [0,1,0,0,0,0|2,0,1]=4 70 B7R0.5 N[C@@H](CCO)C(O)=O HMDB0000719 [0,1,0,0,0,0|2,0,0]=3 71 B7R0.5 N[C@H](CSS)C(O)=O HMDB0003585 [0,1,0,0,0,0|3,0,0]=4 72 B7R0.5 OCCC(=O)C(O)=O HMDB0031204 [0,1,0,0,0,0|2,0,1]=4 73 B7R0.5 OCCC(O)C(O)=O HMDB0000360 [0,1,0,0,0,0|2,0,0]=3 74 B7R0.7 CCCC(=O)/C=C/C HMDB0031488 [0,1,0,0,0,0|2,0,1]=4 75 B7R0.7 CCCC(C)CC=O HMDB0032405 [0,1,0,0,0,0|0,0,0]=1 76 B7R0.7 CCOC(C)OCC HMDB0031644 [0,1,0,0,0,0|2,0,1]=4 77 B7R0.7 CCSC(C)CCO HMDB0032277 [0,1,0,0,0,0|1,0,2]=4 78 B7R0.11 CCCC(C)(C)CC HMDB0031418 [0,1,0,0,0,0|1,0,1]=3 79 B7R0.11 CCCC(C)(S)CO HMDB0032374 [0,1,0,0,0,0|0,0,2]=3 80 B7R0.12 CSC/C(=C/C)C=O HMDB0031370 [0,1,0,0,0,0|1,0,1]=3 81 B7R1.1 O=NN1CCCC1 HMDB0031642 [0,0,0,1,0,0|2,0,0]=3 82 B7R1.2 CC1COC(C)O1 HMDB0032230 [0,0,0,1,0,0|1,0,2]=4 83 B7R1.2 CC1SSC(C)S1 HMDB0031470 [0,0,0,1,0,0|2,1,0]=4 84 B7R1.3 CC1=CC=CCC1 HMDB0031532 [0,0,0,1,0,0|1,0,2]=4 85 B7R1.3 CC1=CCCC=C1 HMDB0032395 [0,0,0,1,0,0|1,0,2]=4 86 B7R1.3 CC1CCCCN1 HMDB0032416 [0,0,0,1,0,0|2,0,0]=3 87 B7R1.3 NC1CCCCC1 HMDB0031404 [0,0,0,1,0,0|2,0,1]=4 88 B7R1.4 CC1=CCCC1=O HMDB0031545 [0,0,0,1,0,0|0,0,2]=3 89 B7R1.4 NC1CCOC1=O HMDB0029387 [0,0,0,1,0,0|2,0,0]=3 90 B7R1.4 NC1CCSC1=O HMDB0002287 [0,0,0,1,0,0|2,0,0]=3 91 B4R0.1 CC(=O)C=O HMDB0001167 [2,0,0,0,0,0|1,0,1]=4 92 B4R0.1 CC(=O)CN HMDB0002134 [2,0,0,0,0,0|1,0,1]=4 93 B4R0.1 CC(=O)CO HMDB0006961 [2,0,0,0,0,0|1,0,1]=4 94 B4R0.1 CC(=O)CS HMDB0030025 [2,0,0,0,0,0|1,0,1]=4 95 B4R0.1 CC(C)C=O HMDB0031243 [2,0,0,0,0,0|0,0,0]=2 96 B4R0.1 CC(C)CO HMDB0006006 [2,0,0,0,0,0|0,0,2]=4 97 B4R0.1 CC(C)CS HMDB0031245 [2,0,0,0,0,0|0,1,1]=4 98 B4R0.1 CC(Cl)CO HMDB0031335 [2,0,0,0,0,0|2,0,0]=4 99 B4R0.1 CC(N)CN HMDB0013136 [2,0,0,0,0,0|2,0,0]=4 100 B4R0.1 CC(O)CN HMDB0012136 [2,0,0,0,0,0|1,0,1]=4 101 B4R0.1 CC(S)CS HMDB0031631 [2,0,0,0,0,0|1,1,0]=4 102 B4R0.1 CCC(C)=O HMDB0000474 [2,0,0,0,0,0|0,0,1]=3 103 B4R0.1 CCC(C)N HMDB0032179 [2,0,0,0,0,0|1,0,0]=3 104 B4R0.1 CCC(C)O HMDB0011469 [2,0,0,0,0,0|0,0,1]=3 105 B4R0.1 CN(C)N=O HMDB0031419 [2,0,0,0,0,0|2,0,0]=4 106 B4R0.1 COC(C)=O HMDB0031523 [2,0,0,0,0,0|1,0,1]=4 107 B4R0.1 CSC(C)=O HMDB0031189 [2,0,0,0,0,0|1,0,1]=4 108 B4R0.1 C[C@@H](O)C=O HMDB0006458 [2,0,0,0,0,0|1,0,0]=3 109 B4R0.1 C[C@H](O)C=O HMDB0003052 [2,0,0,0,0,0|1,0,0]=3 110 B4R0.1 C[C@H](O)CO HMDB0006213 [2,0,0,0,0,0|1,0,1]=4 111 B4R0.2 CCCC=O HMDB0003543 [2,0,0,0,0,0|0,0,0]=2 112 B4R0.2 CCCCC HMDB0029603 [2,0,0,0,0,0|0,0,0]=2 113 B4R0.2 CCCCN HMDB0031321 [2,0,0,0,0,0|1,0,0]=3 114 B4R0.2 CCCCO HMDB0004327 [2,0,0,0,0,0|0,0,1]=3 115 B4R0.2 CCCCS HMDB0031322 [2,0,0,0,0,0|0,1,0]=3 116 B4R0.2 CCCSO HMDB0030299 [2,0,0,0,0,0|1,0,1]=4 117 B4R0.2 CCNCC HMDB0041878 [2,0,0,0,0,0|1,0,0]=3 118 B4R0.2 CCOC=O HMDB0031229 [2,0,0,0,0,0|1,0,0]=3 119 B4R0.2 CCON=O HMDB0031239 [2,0,0,0,0,0|2,0,0]=4 120 B4R0.2 CCSCC HMDB0031666 [2,0,0,0,0,0|1,0,0]=3 121 B4R0.2 CSCC=C HMDB0031653 [2,0,0,0,0,0|1,0,1]=4 122 B4R0.2 CSCC=O HMDB0031718 [2,0,0,0,0,0|1,0,0]=3 123 B4R0.2 CSCCO HMDB0032425 [2,0,0,0,0,0|1,0,1]=4 124 B4R0.2 CSCSC HMDB0031317 [2,0,0,0,0,0|2,0,0]=4 125 B4R0.2 C[Se]CC=C HMDB0030878 [2,0,0,0,0,0|1,0,1]=4 126 B4R0.2 NCCC=O HMDB0001106 [2,0,0,0,0,0|1,0,0]=3 127 B4R0.2 NCCCN HMDB0000002 [2,0,0,0,0,0|2,0,0]=4 128 B4R0.2 O=CCC#C HMDB0006853 [2,0,0,0,0,0|0,0,2]=4 129 B4R0.2 O=CCC=O HMDB0006112 [2,0,0,0,0,0|1,0,1]=4 130 B4R0.2 OCCC=C HMDB0031324 [2,0,0,0,0,0|1,0,1]=4 131 B4R0.2 OCCC=O HMDB0003453 [2,0,0,0,0,0|1,0,0]=3 132 B4R0.2 SCCCS HMDB0031632 [2,0,0,0,0,0|1,1,0]=4 133 B6R0.2 CC(=C)CC(C)=O HMDB0031564 [1,1,0,0,0,0|0,0,2]=4 134 B6R0.2 CC(=O)CC(C)=O HMDB0031648 [1,1,0,0,0,0|0,0,2]=4 135 B6R0.2 CC(C)CC(C)=O HMDB0002939 [1,1,0,0,0,0|0,0,1]=3 136 B6R0.2 CC(C)CC(O)=O HMDB0000718 [1,1,0,0,0,0|1,0,1]=4 137 B6R0.2 CC(C)OC(C)=O HMDB0031241 [1,1,0,0,0,0|1,0,1]=4 138 B6R0.2 CC(C)SC(C)C HMDB0029579 [1,1,0,0,0,0|1,0,1]=4 139 B6R0.2 CC(N)CC(O)=O HMDB0031654 [1,1,0,0,0,0|1,0,1]=4 140 B6R0.2 CC(O)CC(O)=O HMDB0000357 [1,1,0,0,0,0|1,0,1]=4 141 B6R0.2 CC(S)CC(C)=O HMDB0032376 [1,1,0,0,0,0|0,0,1]=3 142 B6R0.2 C[C@@H](O)CC(O)=O HMDB0000011 [1,1,0,0,0,0|1,0,1]=4 143 B6R0.2 C[C@H](O)CC(O)=O HMDB0000442 [1,1,0,0,0,0|1,0,1]=4 144 B6R0.3 CCC(=O)C(C)=O HMDB0031598 [1,1,0,0,0,0|0,0,2]=4 145 B6R0.3 CCC(=O)C(C)C HMDB0005846 [1,1,0,0,0,0|0,0,2]=4 146 B6R0.3 CCC(C)C(O)=O HMDB0002176 [1,1,0,0,0,0|1,0,1]=4 147 B6R0.3 CCC(C)C(O)S HMDB0032373 [1,1,0,0,0,0|1,0,1]=4 148 B6R0.3 CCC(O)C(O)=O HMDB0000008 [1,1,0,0,0,0|1,0,1]=4 149 B6R0.3 CC[C@@H](N)C(O)=O HMDB0000650 [1,1,0,0,0,0|1,0,1]=4 150 B6R0.3 CC[C@H](C)C(O)=O HMDB0033742 [1,1,0,0,0,0|1,0,1]=4 151 B6R0.3 CC[C@H](N)C(O)=O HMDB0000452 [1,1,0,0,0,0|1,0,1]=4 152 B6R0.4 CC(C)CCC=O HMDB0001318 [1,1,0,0,0,0|0,0,2]=4 153 B6R0.4 CCCCC(C)=O HMDB0005842 [1,1,0,0,0,0|0,0,1]=3 154 B6R0.4 CCCCC(O)=O HMDB0000892 [1,1,0,0,0,0|1,0,1]=4 155 B6R0.4 CCNCC(O)=O HMDB0041945 [1,1,0,0,0,0|1,0,1]=4 156 B6R0.4 CCOCC(O)=O HMDB0031212 [1,1,0,0,0,0|1,0,1]=4 157 B6R0.4 CSCCC(C)=O HMDB0031316 [1,1,0,0,0,0|0,0,1]=3 158 B6R0.4 CSCCC(O)=O HMDB0001527 [1,1,0,0,0,0|1,0,1]=4 159 B6R0.4 NCCCC(O)=O HMDB0000112 [1,1,0,0,0,0|1,0,1]=4 160 B6R0.4 OCCCC(O)=O HMDB0000710 [1,1,0,0,0,0|1,0,1]=4 161 B6R0.5 CCC[N+](C)(C)C HMDB0006509 [1,1,0,0,0,0|1,0,1]=4 162 B6R0.6 C/C=C\CCCO HMDB0031502 [1,1,0,0,0,0|1,0,1]=4 163 B6R0.6 CC/C=C\CC=O HMDB0031498 [1,1,0,0,0,0|0,0,1]=3 164 B6R0.6 CCC/C=C/CO HMDB0030952 [1,1,0,0,0,0|0,0,2]=4 165 B6R0.6 CCC=CCC=O HMDB0031497 [1,1,0,0,0,0|0,0,1]=3 166 B6R0.6 CCCC=CC=O HMDB0031496 [1,1,0,0,0,0|0,0,1]=3 167 B6R0.6 CCCCCC=O HMDB0005994 [1,1,0,0,0,0|0,0,0]=2 168 B6R0.6 CCCCCCC HMDB0031447 [1,1,0,0,0,0|1,0,1]=4 169 B6R0.6 CCCCCCN HMDB0032323 [1,1,0,0,0,0|1,0,1]=4 170 B6R0.6 CCCCCCO HMDB0012971 [1,1,0,0,0,0|0,0,2]=4 171 B6R0.6 CCCCCSS HMDB0031160 [1,1,0,0,0,0|0,1,1]=4 172 B6R0.6 CCCCN=C=S HMDB0031328 [1,1,0,0,0,0|0,1,1]=4 173 B6R0.6 CCCCON=O HMDB0031329 [1,1,0,0,0,0|1,0,0]=3 174 B6R0.6 CCCSCCC HMDB0031431 [1,1,0,0,0,0|1,0,1]=4 175 B6R0.6 CNCCCCN HMDB0003661 [1,1,0,0,0,0|1,0,1]=4 176 B6R0.6 NCCCCC=O HMDB0012815 [1,1,0,0,0,0|0,0,0]=2 177 B6R0.6 NCCCCCN HMDB0002322 [1,1,0,0,0,0|1,0,1]=4 178 B6R0.6 O=CCCCC=O HMDB0029599 [1,1,0,0,0,0|0,0,1]=3 179 B6R0.9 CCC(CC)C=O HMDB0031220 [1,1,0,0,0,0|0,0,0]=2 180 B8R0.2 CCC(=O)C(C)C(O)=O HMDB0000408 [0,2,0,0,0,0|0,0,1]=3 181 B8R0.2 CCC(C)C(=O)C(O)=O HMDB0000491 [0,2,0,0,0,0|1,0,1]=4 182 B8R0.2 CCC(C)C(C)C(C)C HMDB0030302 [0,2,0,0,0,0|1,0,1]=4 183 B8R0.2 CCC(O)C(O)C(O)=O HMDB0000421 [0,2,0,0,0,0|1,0,0]=3 184 B8R0.2 CC[C@@H](C)[C@@H](O)C(O)=O HMDB0000317 [0,2,0,0,0,0|1,0,0]=3 185 B8R0.2 CC[C@@H](C)[C@H](N)C(O)=O HMDB0000557 [0,2,0,0,0,0|1,0,0]=3 186 B8R0.2 NC(C(O)CO)C(O)=O HMDB0029389 [0,2,0,0,0,0|2,0,0]=4 187 B8R0.2 OC[C@@H](O)[C@@H](O)C(O)=O HMDB0000613 [0,2,0,0,0,0|2,0,0]=4 188 B8R0.2 OC[C@@H](O)[C@H](O)C(O)=O HMDB0000943 [0,2,0,0,0,0|2,0,0]=4 189 B8R0.5 CCCC(=O)CC(O)=O HMDB0010717 [0,2,0,0,0,0|1,0,1]=4 190 B8R0.5 CCCC(C)CC(C)O HMDB0031589 [0,2,0,0,0,0|0,0,2]=4 191 B8R0.5 CCCC(C)OC(C)=O HMDB0031600 [0,2,0,0,0,0|0,0,0]=2 192 B8R0.5 CCOC(C)OC(C)=O HMDB0032158 [0,2,0,0,0,0|1,0,0]=3 193 B8R0.5 [C@@H](O)(CCC)CC(O)=O HMDB0010718 [0,2,0,0,0,0|1,0,0]=3 194 B8R0.16 OCC(CC)CC(C)C HMDB0013818 [0,2,0,0,0,0|0,0,2]=4 195 B8R0.23 CC(C)/C=C(\C)C(O)=O HMDB0039819 [0,2,0,0,0,0|0,0,2]=4 196 B8R0.23 CC(C)CC(=O)C(C)=O HMDB0031593 [0,2,0,0,0,0|1,0,1]=4 197 B8R0.23 CC(C)CC(=O)C(O)=O HMDB0000695 [0,2,0,0,0,0|1,0,1]=4 198 B8R0.23 CC(C)CC(O)C(O)=O HMDB0000665 [0,2,0,0,0,0|1,0,0]=3 199 B8R0.23 CC(C)C[C@@H](N)C(O)=O HMDB0013773 [0,2,0,0,0,0|1,0,0]=3 200 B8R0.23 CC(C)C[C@@H](O)C(O)=O HMDB0000624 [0,2,0,0,0,0|1,0,0]=3 201 B8R0.23 CC(C)C[C@H](O)C(O)=O HMDB0000746 [0,2,0,0,0,0|1,0,0]=3 202 B8R0.23 CC(CC(O)=O)C(O)=O HMDB0001844 [0,2,0,0,0,0|1,0,1]=4 203 B8R0.23 CS(=O)CC(N)C(O)=O HMDB0029432 [0,2,0,0,0,0|2,0,0]=4 204 B8R0.23 C[C@H](NC(C)=O)C(O)=O HMDB0000766 [0,2,0,0,0,0|1,0,1]=4 205 B8R0.1 CCCCC(O)/C=C/C HMDB0031300 [0,2,0,0,0,0|2,0,0]=4 206 B8R0.3 CCCC(=O)C(=O)CC HMDB0031477 [0,2,0,0,0,0|1,0,1]=4 207 B8R0.3 CCCC(C)C(=O)OC HMDB0036237 [0,2,0,0,0,0|0,0,0]=2 208 B8R0.3 CCCC(C)C(C)CC HMDB0031416 [0,2,0,0,0,0|1,0,1]=4 209 B8R0.6 CC/C=C/CC(O)C=C HMDB0030966 [0,2,0,0,0,0|2,0,0]=4 210 B8R0.6 CCCCCC(O)C=C HMDB0031299 [0,2,0,0,0,0|2,0,0]=4 211 B8R0.8 CCC/C=C(\C)C(C)=O HMDB0031590 [0,2,0,0,0,0|0,0,1]=3 212 B8R0.8 CCCCC(=O)C(C)=O HMDB0031476 [0,2,0,0,0,0|1,0,1]=4 213 B8R0.8 CCCCC(=O)C(O)=O HMDB0001864 [0,2,0,0,0,0|1,0,1]=4 214 B8R0.8 CCCCC(C)C(O)=O HMDB0031594 [0,2,0,0,0,0|0,0,0]=2 215 B8R0.8 CCCCC(O)C(O)=O HMDB0001624 [0,2,0,0,0,0|1,0,0]=3 216 B8R0.8 CCCC[C@H](N)C(O)=O HMDB0001645 [0,2,0,0,0,0|1,0,0]=3 217 B8R0.8 CSCCC(=O)C(O)=O HMDB0001553 [0,2,0,0,0,0|1,0,1]=4 218 B8R0.8 CSCCC(O)C(O)=O HMDB0037115 [0,2,0,0,0,0|1,0,0]=3 219 B8R0.8 C[Se]CCC(N)C(O)=O HMDB0003966 [0,2,0,0,0,0|1,0,0]=3 220 B8R0.8 NC(CCCO)C(O)=O HMDB0031658 [0,2,0,0,0,0|1,0,0]=3 221 B8R0.8 NCCCC(=O)C(O)=O HMDB0006272 [0,2,0,0,0,0|1,0,1]=4 222 B8R0.8 NCCCC(N)C(O)=O HMDB0032455 [0,2,0,0,0,0|1,0,0]=3 223 B8R0.8 NCCC[C@@H](N)C(O)=O HMDB0003374 [0,2,0,0,0,0|1,0,0]=3 224 B8R0.8 NCCC[C@H](N)C(O)=O HMDB0000214 [0,2,0,0,0,0|1,0,0]=3 225 B8R0.8 NOCC[C@H](N)C(O)=O HMDB0012251 [0,2,0,0,0,0|2,0,0]=4 226 B8R0.8 N[C@@H](CCC=O)C(O)=O HMDB0002104 [0,2,0,0,0,0|1,0,1]=4 227 B8R0.9 C/C=C(/C)CCC(C)=O HMDB0031591 [0,2,0,0,0,0|1,0,1]=4 228 B8R0.9 CC(O)COC(C)CO HMDB0032478 [0,2,0,0,0,0|0,0,2]=4 229 B8R0.11 CCCCC(CC)CO HMDB0031231 [0,2,0,0,0,0|0,0,2]=4 230 B6R1.2 CC1CCC=C1 HMDB0031544 [1,0,0,1,0,0|0,0,1]=3 231 B6R1.2 CC1CCCC1 HMDB0031542 [1,0,0,1,0,0|0,0,1]=3 232 B6R1.2 CC1NCCS1 HMDB0031682 [1,0,0,1,0,0|1,1,0]=4 233 B6R1.2 O=C1CCCC1 HMDB0031407 [1,0,0,1,0,0|0,0,1]=3 234 B6R1.2 O=C1CCCN1 HMDB0002039 [1,0,0,1,0,0|1,0,1]=4 235 B6R1.2 O=C1CCCO1 HMDB0000549 [1,0,0,1,0,0|1,0,1]=4 236 B6R1.2 O=C1CCCS1 HMDB0031253 [1,0,0,1,0,0|1,0,1]=4 237 B6R1.2 O=C1CCOC1 HMDB0002523 [1,0,0,1,0,0|1,0,1]=4 238 B6R1.2 O=C1CCSC1 HMDB0031242 [1,0,0,1,0,0|1,0,1]=4 239 B6R1.1 C1CCCCC1 HMDB0029597 [1,0,0,1,0,0|1,0,1]=4 240 B8R1.4 CC1=CC(=O)CCC1 HMDB0031541 [0,1,0,1,0,0|0,0,1]=3 241 B8R1.4 CC1CCCC(=O)O1 HMDB0000453 [0,1,0,1,0,0|0,0,0]=2 242 B8R1.4 CC1CCCC(O)C1 HMDB0031538 [0,1,0,1,0,0|0,0,2]=4 243 B8R1.4 CC1CCCC(S)C1 HMDB0031537 [0,1,0,1,0,0|0,1,1]=4 244 B8R1.18 CC1OC(C)=CC1=O HMDB0032233 [0,1,0,1,0,0|1,0,1]=4 245 B8R1.18 CC1OC(C)C(C)=N1 HMDB0031199 [0,1,0,1,0,0|2,0,0]=4 246 B8R1.2 O=CN1CCCCC1 HMDB0031702 [0,1,0,1,0,0|1,0,0]=3 247 B8R1.5 CC1CCCCC1=O HMDB0031539 [0,1,0,1,0,0|0,0,0]=2 248 B8R1.5 NC1CCCNC1=O HMDB0000323 [0,1,0,1,0,0|1,0,0]=3 249 B8R1.5 O=C1CCCCC1=O HMDB0031344 [0,1,0,1,0,0|1,0,1]=4 250 B8R1.50 CC1CCC(=O)C1=O HMDB0031543 [0,1,0,1,0,0|0,0,1]=3 251 B8R1.50 O[C@@H]1COC(=O)[C@@H]1O HMDB0000349 [0,1,0,1,0,0|2,0,0]=4 252 B8R1.50 O[C@H]1COC(=O)[C@@H]1O HMDB0000940 [0,1,0,1,0,0|2,0,0]=4 253 B8R1.7 CC(=O)C1=NCCC1 HMDB0031308 [0,1,0,1,0,0|1,0,1]=4 254 B8R1.7 OC(=O)C1CCC=N1 HMDB0001301 [0,1,0,1,0,0|1,0,1]=4 255 B8R1.7 OC(=O)C1CSSC1 HMDB0029611 [0,1,0,1,0,0|2,0,0]=4 256 B8R1.7 OC(=O)[C@@H]1CCCN1 HMDB0000162 [0,1,0,1,0,0|1,0,0]=3 257 B8R1.7 OC(=O)[C@H]1CCCN1 HMDB0003411 [0,1,0,1,0,0|1,0,0]=3 258 B8R1.7 [O-]C(=O)C1=[NH+]CCC1 HMDB0006875 [0,1,0,1,0,0|1,0,1]=4