0 B6R0.6 C/C=C/C=C\C=O HMDB0034729 [0,0,0,0,0,0|0,0,4]=4 1 B6R0.6 C/C=C/CCC=O HMDB0040271 [0,0,0,0,0,0|0,0,4]=4 2 B6R0.6 C/C=C\CCC=O HMDB0033549 [0,0,0,0,0,0|0,0,4]=4 3 B6R0.6 C/C=C\CCCO HMDB0031502 [0,0,0,0,0,0|0,0,2]=2 4 B6R0.6 CC/C=C\CC=O HMDB0031498 [0,0,0,0,0,0|0,0,2]=2 5 B6R0.6 CC/C=C\CCO HMDB0030003 [0,0,0,0,0,0|0,0,0]=0 6 B6R0.6 CCC/C=C/CO HMDB0030952 [0,0,0,0,0,0|0,0,2]=2 7 B6R0.6 CCC/C=C\C=O HMDB0040264 [0,0,0,0,0,0|2,0,1]=3 8 B6R0.6 CCC=CCC=O HMDB0031497 [0,0,0,0,0,0|0,0,2]=2 9 B6R0.6 CCCC=CC=O HMDB0031496 [0,0,0,0,0,0|2,0,1]=3 10 B6R0.6 CCCCCCC HMDB0031447 [0,0,0,0,0,0|1,0,2]=3 11 B6R0.6 CCCCCCN HMDB0032323 [0,0,0,0,0,0|1,0,2]=3 12 B6R0.6 CCCCCCO HMDB0012971 [0,0,0,0,0,0|0,0,2]=2 13 B6R0.6 CCCCCCS HMDB0039806 [0,0,0,0,0,0|0,1,2]=3 14 B6R0.6 CCCCCSS HMDB0031160 [0,0,0,0,0,0|1,1,2]=4 15 B6R0.6 CCCS/C=C/C HMDB0040244 [0,0,0,0,0,0|2,0,1]=3 16 B6R0.6 CCCSCCC HMDB0031431 [0,0,0,0,0,0|2,0,1]=3 17 B6R0.6 CCCSSCC HMDB0033053 [0,0,0,0,0,0|3,0,0]=3 18 B6R0.6 CCCSSSC HMDB0031871 [0,0,0,0,0,0|4,0,0]=4 19 B6R0.6 CCSSCSC HMDB0033047 [0,0,0,0,0,0|4,0,0]=4 20 B6R0.6 CCSSSCC HMDB0039524 [0,0,0,0,0,0|4,0,0]=4 21 B6R0.6 CSCCCCO HMDB0041562 [0,0,0,0,0,0|1,0,2]=3 22 B6R0.6 NCCNCCN HMDB0031413 [0,0,0,0,0,0|3,0,1]=4 23 B5R0.2 CC/C=C/SC HMDB0038892 [1,0,0,0,0,0|1,0,0]=2 24 B5R0.2 CC/C=C\C=O HMDB0031601 [1,0,0,0,0,0|0,0,2]=3 25 B5R0.2 CC/C=C\CO HMDB0031604 [1,0,0,0,0,0|0,0,0]=1 26 B5R0.2 CCCCC#N HMDB0040173 [1,0,0,0,0,0|1,0,2]=4 27 B5R0.2 CCCCC=O HMDB0031206 [1,0,0,0,0,0|0,0,3]=4 28 B5R0.2 CCCCCC HMDB0029600 [1,0,0,0,0,0|0,0,2]=3 29 B5R0.2 CCCCCS HMDB0032457 [1,0,0,0,0,0|0,1,1]=3 30 B5R0.2 CCCOC=O HMDB0040253 [1,0,0,0,0,0|3,0,0]=4 31 B5R0.2 CCCSSC HMDB0031872 [1,0,0,0,0,0|2,0,1]=4 32 B5R0.2 CCOCCO HMDB0031213 [1,0,0,0,0,0|1,0,0]=2 33 B5R0.2 CCSSCC HMDB0029572 [1,0,0,0,0,0|2,0,0]=3 34 B5R0.2 CCSSSC HMDB0038891 [1,0,0,0,0,0|3,0,0]=4 35 B5R0.2 CSCCCO HMDB0031716 [1,0,0,0,0,0|1,0,1]=3 36 B5R0.2 CSS/C=C\C HMDB0041391 [1,0,0,0,0,0|2,0,1]=4 37 B5R0.2 C[Se]S/C=C/C HMDB0030880 [1,0,0,0,0,0|2,0,1]=4 38 B7R0.1 C/C=C\C/C=C/CO HMDB0040339 [0,1,0,0,0,0|0,0,2]=3 39 B7R0.1 CC/C=C/C=C/CO HMDB0032301 [0,1,0,0,0,0|0,0,1]=2 40 B7R0.1 CC/C=C\CCC=O HMDB0031483 [0,1,0,0,0,0|0,0,1]=2 41 B7R0.1 CC/C=C\CCCO HMDB0031405 [0,1,0,0,0,0|0,0,0]=1 42 B7R0.1 CCCC/C=C/C=C HMDB0040966 [0,1,0,0,0,0|1,0,2]=4 43 B7R0.1 CCCC/C=C/C=O HMDB0033827 [0,1,0,0,0,0|2,0,1]=4 44 B7R0.1 CCCCCCC=C HMDB0032449 [0,1,0,0,0,0|1,0,2]=4 45 B7R0.1 CCCCCCC=O HMDB0031475 [0,1,0,0,0,0|0,0,3]=4 46 B7R0.1 CCCCCCCO HMDB0031479 [0,1,0,0,0,0|0,0,2]=3 47 B7R0.1 CCCCCCCS HMDB0032304 [0,1,0,0,0,0|0,1,2]=4 48 B7R0.1 CCCCCCOC HMDB0032407 [0,1,0,0,0,0|0,0,2]=3 49 B7R0.1 CCCCOCCO HMDB0031327 [0,1,0,0,0,0|0,0,2]=3 50 B7R0.1 CCCCSSCC HMDB0032180 [0,1,0,0,0,0|2,0,1]=4 51 B7R0.1 CCCSS/C=C\C HMDB0041392 [0,1,0,0,0,0|2,0,1]=4 52 B7R0.1 CCCSSCCC HMDB0031472 [0,1,0,0,0,0|2,0,1]=4 53 B7R0.1 CCSCSSCC HMDB0033056 [0,1,0,0,0,0|3,0,0]=4 54 B7R0.1 SCCCCCCS HMDB0031709 [0,1,0,0,0,0|0,1,2]=4 55 B7R0.3 CCC(=O)/C=C/C=O HMDB0031759 [0,1,0,0,0,0|0,0,3]=4 56 B7R0.3 CCC(=O)OCC=C HMDB0029487 [0,1,0,0,0,0|2,0,1]=4 57 B7R0.3 CCC(=O)SCC=C HMDB0037493 [0,1,0,0,0,0|2,0,1]=4 58 B7R0.3 CCCCC(=O)CC HMDB0031482 [0,1,0,0,0,0|1,0,1]=3 59 B7R0.3 CCCCC(=O)OC HMDB0031207 [0,1,0,0,0,0|2,0,1]=4 60 B7R0.3 CCCCC(C)CC HMDB0031583 [0,1,0,0,0,0|1,0,2]=4 61 B7R0.3 CCCCC(O)CC HMDB0031481 [0,1,0,0,0,0|1,0,2]=4 62 B7R0.3 CCCOC(=O)CC HMDB0030059 [0,1,0,0,0,0|2,0,0]=3 63 B7R0.3 CCCSC(S)CC HMDB0040056 [0,1,0,0,0,0|2,0,1]=4 64 B7R0.4 C/C=C/C=C/C(O)=O HMDB0029581 [0,1,0,0,0,0|0,0,3]=4 65 B7R0.4 CC(O)CCCCO HMDB0031490 [0,1,0,0,0,0|0,0,2]=3 66 B7R0.4 CC/C=C/CC(C)=O HMDB0031487 [0,1,0,0,0,0|0,0,2]=3 67 B7R0.4 CC/C=C\CC(C)O HMDB0041320 [0,1,0,0,0,0|0,0,0]=1 68 B7R0.4 CC/C=C\CC(O)=O HMDB0031501 [0,1,0,0,0,0|0,0,1]=2 69 B7R0.4 CCC/C=C/C(C)=O HMDB0031486 [0,1,0,0,0,0|1,0,1]=3 70 B7R0.4 CCC/C=C/C(O)=O HMDB0010719 [0,1,0,0,0,0|0,0,3]=4 71 B7R0.4 CCCCCC(C)O HMDB0033908 [0,1,0,0,0,0|0,0,2]=3 72 B7R0.4 CCCCCC(C)S HMDB0032303 [0,1,0,0,0,0|0,1,2]=4 73 B7R0.4 CCCCCC(O)=O HMDB0000535 [0,1,0,0,0,0|0,0,3]=4 74 B7R0.4 CCCNCC(C)C HMDB0031244 [0,1,0,0,0,0|2,0,1]=4 75 B7R0.4 CSS/C=C/C(C)C HMDB0038890 [0,1,0,0,0,0|3,0,0]=4 76 B7R0.7 CCCC(=O)/C=C/C HMDB0031488 [0,1,0,0,0,0|1,0,1]=3 77 B7R0.7 CCCC(=O)OCC HMDB0033889 [0,1,0,0,0,0|2,0,0]=3 78 B7R0.7 CCCC(S)CCO HMDB0040152 [0,1,0,0,0,0|0,0,2]=3 79 B7R0.7 CCOC(=O)/C=C\C HMDB0039581 [0,1,0,0,0,0|2,0,1]=4 80 B7R0.7 CCOC(=O)CCS HMDB0040410 [0,1,0,0,0,0|1,1,0]=3 81 B7R0.7 CCOC(=O)CSC HMDB0040263 [0,1,0,0,0,0|3,0,0]=4 82 B7R0.7 CCSC(C)CCO HMDB0032277 [0,1,0,0,0,0|1,0,1]=3 83 B7R1.1 CCC1=CC=CO1 HMDB0040587 [0,0,0,1,0,0|0,0,2]=3 84 B7R1.1 CCC1=CC=CS1 HMDB0035384 [0,0,0,1,0,0|0,1,2]=4 85 B7R1.1 CCC1=COC=C1 HMDB0040588 [0,0,0,1,0,0|2,0,1]=4 86 B7R1.1 CCC1=CSC=C1 HMDB0035385 [0,0,0,1,0,0|2,0,1]=4 87 B7R1.1 OCC1=CC=CO1 HMDB0013742 [0,0,0,1,0,0|1,0,2]=4 88 B7R1.1 OCC1=CC=CS1 HMDB0032993 [0,0,0,1,0,0|1,0,2]=4 89 B7R1.1 OCC1=CSC=C1 HMDB0041504 [0,0,0,1,0,0|1,0,2]=4 90 B7R1.1 OCC1CCCO1 HMDB0031175 [0,0,0,1,0,0|1,0,1]=3 91 B7R1.1 SCC1=CC=CO1 HMDB0032915 [0,0,0,1,0,0|1,0,2]=4 92 B7R1.3 CC1=CC=CCC1 HMDB0031532 [0,0,0,1,0,0|1,0,2]=4 93 B7R1.3 CC1=CCCC=C1 HMDB0032395 [0,0,0,1,0,0|1,0,1]=3 94 B7R1.3 CC1CCCCN1 HMDB0032416 [0,0,0,1,0,0|1,0,2]=4 95 B7R1.3 CC1OCCCS1 HMDB0039826 [0,0,0,1,0,0|1,0,1]=3 96 B7R1.3 CC1SCCSS1 HMDB0037290 [0,0,0,1,0,0|2,1,0]=4 97 B7R1.3 NC1CCCCC1 HMDB0031404 [0,0,0,1,0,0|1,0,2]=4 98 B7R1.3 O=C1CCC=CO1 HMDB0040145 [0,0,0,1,0,0|1,0,2]=4 99 B7R1.4 CC1OCCC1O HMDB0039799 [0,0,0,1,0,0|1,0,1]=3 100 B7R1.4 CC1OCCC1S HMDB0036138 [0,0,0,1,0,0|1,1,1]=4 101 B7R1.4 CC1SCCC1O HMDB0035244 [0,0,0,1,0,0|1,0,1]=3 102 B7R1.4 CC1SCCC1S HMDB0039790 [0,0,0,1,0,0|1,1,1]=4 103 B4R0.2 C/C=C/SO HMDB0031636 [2,0,0,0,0,0|1,0,0]=3 104 B4R0.2 C/C=C\C=O HMDB0034233 [2,0,0,0,0,0|0,0,2]=4 105 B4R0.2 C/C=C\CO HMDB0033858 [2,0,0,0,0,0|0,0,0]=2 106 B4R0.2 C=CCC#N HMDB0031323 [2,0,0,0,0,0|1,0,1]=4 107 B4R0.2 CCC=S=O HMDB0040346 [2,0,0,0,0,0|1,0,1]=4 108 B4R0.2 CCCCC HMDB0029603 [2,0,0,0,0,0|0,0,1]=3 109 B4R0.2 CCCCN HMDB0031321 [2,0,0,0,0,0|1,0,0]=3 110 B4R0.2 CCCCS HMDB0031322 [2,0,0,0,0,0|0,1,0]=3 111 B4R0.2 CCCSO HMDB0030299 [2,0,0,0,0,0|1,0,0]=3 112 B4R0.2 CCOC=O HMDB0031229 [2,0,0,0,0,0|1,0,1]=4 113 B4R0.2 CCSCC HMDB0031666 [2,0,0,0,0,0|1,0,0]=3 114 B4R0.2 CCSSC HMDB0032912 [2,0,0,0,0,0|2,0,0]=4 115 B4R0.2 CSCC=C HMDB0031653 [2,0,0,0,0,0|2,0,0]=4 116 B4R0.2 CSCCO HMDB0032425 [2,0,0,0,0,0|1,0,0]=3 117 B4R0.2 C[Se]CC=C HMDB0030878 [2,0,0,0,0,0|2,0,0]=4 118 B4R0.2 OCCC=C HMDB0031324 [2,0,0,0,0,0|0,0,0]=2 119 B4R0.2 SCCCS HMDB0031632 [2,0,0,0,0,0|1,1,0]=4 120 B6R0.1 CC/C=C(/C)C=O HMDB0033714 [1,1,0,0,0,0|0,0,2]=4 121 B6R0.1 CCC(=O)/C=C/C HMDB0035239 [1,1,0,0,0,0|0,0,1]=3 122 B6R0.1 CCC(=O)CSC HMDB0037193 [1,1,0,0,0,0|1,0,1]=4 123 B6R0.1 CCC(C)CCO HMDB0033676 [1,1,0,0,0,0|0,0,1]=3 124 B6R0.1 CCCC(=O)OC HMDB0033890 [1,1,0,0,0,0|1,0,1]=4 125 B6R0.1 CCCC(=O)SC HMDB0031191 [1,1,0,0,0,0|1,0,1]=4 126 B6R0.1 CCCC(O)CC HMDB0031493 [1,1,0,0,0,0|0,0,2]=4 127 B6R0.1 CCOC(=O)CC HMDB0030058 [1,1,0,0,0,0|1,0,0]=3 128 B6R0.1 CCOC(C)CC HMDB0031326 [1,1,0,0,0,0|1,0,1]=4 129 B6R0.1 CSC/C(C)=C/C HMDB0032411 [1,1,0,0,0,0|2,0,0]=4 130 B6R0.4 CC(=O)OCCN HMDB0038394 [1,1,0,0,0,0|2,0,0]=4 131 B6R0.4 CC(C)/C=C\C=O HMDB0031196 [1,1,0,0,0,0|0,0,2]=4 132 B6R0.4 CC/C=C/C(O)=O HMDB0032459 [1,1,0,0,0,0|0,0,1]=3 133 B6R0.4 CCCCC(O)=O HMDB0000892 [1,1,0,0,0,0|0,0,2]=4 134 B6R0.4 CCCOC(C)=O HMDB0034237 [1,1,0,0,0,0|2,0,0]=4 135 B6R0.4 CCCSC(C)=O HMDB0033856 [1,1,0,0,0,0|2,0,0]=4 136 B6R0.4 CCOCC(O)=O HMDB0031212 [1,1,0,0,0,0|1,0,1]=4 137 B6R0.4 CCSSC(C)C HMDB0033054 [1,1,0,0,0,0|2,0,0]=4 138 B6R0.4 CSCCC(C)O HMDB0041476 [1,1,0,0,0,0|1,0,1]=4 139 B8R0.1 CCCC(=O)OCSC HMDB0038299 [0,2,0,0,0,0|2,0,0]=4 140 B8R0.1 CCCCC(=O)/C=C\C HMDB0031301 [0,2,0,0,0,0|1,0,1]=4 141 B8R0.1 CCCCC(=O)OCC HMDB0040297 [0,2,0,0,0,0|1,0,1]=4 142 B8R0.1 CCCOC(=O)CCC HMDB0039618 [0,2,0,0,0,0|1,0,1]=4 143 B8R0.1 CCOC(=O)CCC=C HMDB0031603 [0,2,0,0,0,0|2,0,0]=4 144 B8R0.1 CCOC(=O)CCSC HMDB0040413 [0,2,0,0,0,0|1,1,0]=4 145 B8R0.4 CC/C=C/C/C=C\CO HMDB0040146 [0,2,0,0,0,0|0,0,0]=2 146 B8R0.4 CC/C=C/C=C/CCO HMDB0040149 [0,2,0,0,0,0|0,0,0]=2 147 B8R0.4 CC/C=C/CCCC=O HMDB0039770 [0,2,0,0,0,0|0,0,1]=3 148 B8R0.4 CC/C=C\CCCCO HMDB0031298 [0,2,0,0,0,0|0,0,0]=2 149 B8R0.4 CC/C=C\CCOC=O HMDB0040214 [0,2,0,0,0,0|0,0,0]=2 150 B8R0.4 CCC/C=C/C=C\CO HMDB0040151 [0,2,0,0,0,0|0,0,1]=3 151 B8R0.4 CCC/C=C/COC=O HMDB0038271 [0,2,0,0,0,0|0,0,2]=4 152 B8R0.4 CCCC/C=C/CCO HMDB0035768 [0,2,0,0,0,0|0,0,0]=2 153 B8R0.4 CCCC/C=C\CCO HMDB0035231 [0,2,0,0,0,0|0,0,0]=2 154 B8R0.4 CCCCC/C=C\CO HMDB0031296 [0,2,0,0,0,0|0,0,2]=4 155 B8R0.4 CCCCCCCCO HMDB0001183 [0,2,0,0,0,0|0,0,2]=4 156 B8R0.4 CCCCCCOC=O HMDB0032874 [0,2,0,0,0,0|0,0,2]=4 157 B8R0.4 CS/C=C\CCN=C=S HMDB0031576 [0,2,0,0,0,0|1,1,0]=4 158 B8R0.6 CC/C=C/CC(=O)C=C HMDB0032447 [0,2,0,0,0,0|0,0,2]=4 159 B8R0.6 CC/C=C/CC(O)C=C HMDB0030966 [0,2,0,0,0,0|0,0,0]=2 160 B8R0.6 CC/C=C\CC(=O)OC HMDB0031504 [0,2,0,0,0,0|0,0,1]=3 161 B8R0.6 CCC/C=C/C(=O)CC HMDB0032451 [0,2,0,0,0,0|1,0,0]=3 162 B8R0.6 CCC/C=C/C(=O)OC HMDB0031500 [0,2,0,0,0,0|1,0,1]=4 163 B8R0.6 CCCCCC(=O)CC HMDB0031295 [0,2,0,0,0,0|1,0,1]=4 164 B8R0.6 CCCCCC(O)C=C HMDB0031299 [0,2,0,0,0,0|0,0,2]=4 165 B8R0.6 CCCCCC(O)CC HMDB0030070 [0,2,0,0,0,0|0,0,2]=4 166 B8R0.6 CCCCOC(=O)CC HMDB0030052 [0,2,0,0,0,0|1,0,1]=4 167 B8R0.7 CC/C=C\CCC(C)=O HMDB0035390 [0,2,0,0,0,0|0,0,1]=3 168 B8R0.7 CC/C=C\CCC(O)=O HMDB0033793 [0,2,0,0,0,0|0,0,0]=2 169 B8R0.7 CCCC/C=C/C(C)=O HMDB0033547 [0,2,0,0,0,0|1,0,1]=4 170 B8R0.7 CCCC/C=C/C(C)O HMDB0032450 [0,2,0,0,0,0|1,0,0]=3 171 B8R0.7 CCCCCCC(C)O HMDB0034261 [0,2,0,0,0,0|0,0,2]=4 172 B8R0.7 CCCCCCC(O)=O HMDB0000666 [0,2,0,0,0,0|0,0,2]=4 173 B8R0.3 CCC(=C)C(=O)COC HMDB0030330 [0,2,0,0,0,0|2,0,0]=4 174 B8R0.3 CCC(C)C(=O)/C=C\C HMDB0035242 [0,2,0,0,0,0|1,0,1]=4 175 B8R0.3 CCCC(=O)C(=O)CC HMDB0031477 [0,2,0,0,0,0|1,0,0]=3 176 B8R0.3 CCOC(=O)C(C)CC HMDB0033745 [0,2,0,0,0,0|2,0,0]=4 177 B8R0.8 CC(O)C(=O)NCCO HMDB0032356 [0,2,0,0,0,0|1,0,0]=3 178 B8R0.8 CCC/C=C(\C)C(C)=O HMDB0031590 [0,2,0,0,0,0|1,0,1]=4 179 B8R0.8 CCCCC(=O)C(C)C HMDB0032402 [0,2,0,0,0,0|1,0,1]=4 180 B8R0.8 CCCOC(=O)C(C)C HMDB0036209 [0,2,0,0,0,0|2,0,0]=4 181 B8R0.8 CCCOC(=O)C(C)S HMDB0032495 [0,2,0,0,0,0|2,0,0]=4 182 B8R0.9 CC(O)COC(C)CO HMDB0032478 [0,2,0,0,0,0|1,0,1]=4 183 B8R0.9 CCC(=O)OCC(C)C HMDB0034239 [0,2,0,0,0,0|2,0,0]=4 184 B8R0.11 CCCCC(CC)CO HMDB0031231 [0,2,0,0,0,0|0,0,2]=4 185 B8R0.19 CCC(C)CC(C)CO HMDB0037791 [0,2,0,0,0,0|0,0,2]=4 186 B8R0.5 CCCC(=O)OC(C)C HMDB0039619 [0,2,0,0,0,0|2,0,0]=4 187 B8R0.5 CCCC(C)CC(C)O HMDB0031589 [0,2,0,0,0,0|0,0,2]=4 188 B8R0.5 CCOC(=O)CC(C)C HMDB0030028 [0,2,0,0,0,0|2,0,0]=4 189 B8R0.5 CCOC(=O)CC(C)O HMDB0040409 [0,2,0,0,0,0|1,0,0]=3 190 B8R0.5 CCOC(=O)CC(C)S HMDB0032271 [0,2,0,0,0,0|1,1,0]=4 191 B8R0.28 CC(C)C/C=C/C(C)=O HMDB0032403 [0,2,0,0,0,0|1,0,1]=4 192 B8R0.28 CC(O)CCC=C(C)C HMDB0030030 [0,2,0,0,0,0|0,0,2]=4 193 B8R0.22 CCCC(CCO)SC HMDB0040153 [0,2,0,0,0,0|0,0,2]=4 194 B6R1.1 C1CCCCC1 HMDB0029597 [1,0,0,1,0,0|0,0,2]=4 195 B6R1.1 C1CCNCC1 HMDB0034301 [1,0,0,1,0,0|1,0,1]=4 196 B6R1.1 C1COCCN1 HMDB0031581 [1,0,0,1,0,0|1,0,0]=3 197 B6R1.1 C1CSCCS1 HMDB0031474 [1,0,0,1,0,0|1,1,0]=4 198 B6R1.2 CC1=CCCS1 HMDB0033565 [1,0,0,1,0,0|0,1,0]=3 199 B6R1.2 CC1=COCC1 HMDB0040584 [1,0,0,1,0,0|1,0,1]=4 200 B6R1.2 CC1=NCCS1 HMDB0029555 [1,0,0,1,0,0|1,1,0]=4 201 B6R1.2 CC1CC=CS1 HMDB0033564 [1,0,0,1,0,0|1,0,1]=4 202 B6R1.2 CC1CCC=C1 HMDB0031544 [1,0,0,1,0,0|0,0,0]=2 203 B6R1.2 CC1CCCC1 HMDB0031542 [1,0,0,1,0,0|0,0,2]=4 204 B6R1.2 CC1CNC=C1 HMDB0033529 [1,0,0,1,0,0|1,0,0]=3 205 B6R1.2 CC1COC=C1 HMDB0037788 [1,0,0,1,0,0|1,0,0]=3 206 B6R1.2 CC1NCCS1 HMDB0031682 [1,0,0,1,0,0|1,1,0]=4 207 B6R1.2 CC1SCCS1 HMDB0036179 [1,0,0,1,0,0|1,1,0]=4 208 B6R1.2 O=C1OCC=C1 HMDB0032330 [1,0,0,1,0,0|1,0,1]=4 209 B6R1.2 SC1CCCC1 HMDB0039771 [1,0,0,1,0,0|0,1,1]=4 210 B8R1.5 CC1CCCCC1=O HMDB0031539 [0,1,0,1,0,0|1,0,1]=4 211 B8R1.8 CCCC1=CC=CO1 HMDB0040277 [0,1,0,1,0,0|0,0,2]=4 212 B8R1.8 COCC1=CC=CO1 HMDB0034247 [0,1,0,1,0,0|0,0,2]=4 213 B8R1.8 CSCC1=CC=CO1 HMDB0032916 [0,1,0,1,0,0|0,0,2]=4 214 B8R1.11 CCC1=C(C)N=CO1 HMDB0037863 [0,1,0,1,0,0|1,0,1]=4 215 B8R1.11 CCC1SCCC1=O HMDB0040238 [0,1,0,1,0,0|0,1,1]=4 216 B8R1.1 CCC1=CC=C(C)O1 HMDB0029728 [0,1,0,1,0,0|0,0,2]=4 217 B8R1.1 CCC1=CN=C(C)O1 HMDB0037859 [0,1,0,1,0,0|1,0,1]=4 218 B8R1.3 CC1CCC(=O)CC1 HMDB0031540 [0,1,0,1,0,0|1,0,1]=4 219 B8R1.4 CC1=CC(=O)CCC1 HMDB0031541 [0,1,0,1,0,0|1,0,1]=4 220 B8R1.4 CC1=CCCC(O)C1 HMDB0034372 [0,1,0,1,0,0|0,0,0]=2 221 B8R1.4 CC1CCCC(=O)C1 HMDB0033667 [0,1,0,1,0,0|1,0,1]=4 222 B8R1.4 CC1CCCC(O)C1 HMDB0031538 [0,1,0,1,0,0|0,0,2]=4 223 B8R1.7 CC(C)C1=CC=CO1 HMDB0040278 [0,1,0,1,0,0|0,0,2]=4 224 B8R1.7 CC(S)C1=CC=CO1 HMDB0039586 [0,1,0,1,0,0|0,0,2]=4