Spaces:
Runtime error
Runtime error
| cid name dG'0 pH I pMg T decompose compound_ref remark | |
| C00001 H2O -155.7 7 0.25 14 298.15 0 Alberty (2006) | |
| C00002 ATP -2293.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00007 Oxygen 16.4 7 0.25 14 298.15 0 Alberty (2006) | |
| C00008 ADP -1423.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C00009 Orthophosphate -1059.1 7 0.25 14 298.15 0 Alberty (2006) | |
| C00011 CO2 -386 7 0.25 14 298.15 0 Alberty (2006) | |
| C00013 Diphosphate -1942.8 7 0.25 14 298.15 0 Alberty (2006) | |
| C00014 NH3 82.8 7 0.25 14 298.15 0 Alberty (2006) | |
| C00020 AMP -554.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C00022 Pyruvate -350.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C00023 Iron 0 7 0.25 14 298.15 0 Element | |
| C00025 L-Glutamate -372.4 7 0.25 14 298.15 1 Alberty (2006) | |
| C00026 2-Oxoglutarate -633.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00027 Hydrogen peroxide -52.5 7 0.25 14 298.15 0 Alberty (2006) | |
| C00031 D-Glucose -427 7 0.25 14 298.15 1 Alberty (2006) | |
| C00033 Acetate -247.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C00034 Manganese 0 7 0.25 14 298.15 0 Element | |
| C00036 Oxaloacetate -715 7 0.25 14 298.15 1 Alberty (2006) | |
| C00037 Glycine -176.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00041 L-Alanine -85.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C00042 Succinate -530.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00048 Glyoxylate -428.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00049 L-Aspartate -452.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00058 Formate -311.1 7 0.25 14 298.15 0 Alberty (2006) | |
| C00059 Sulfate -747.8 7 0.25 14 298.15 0 Alberty (2006) | |
| C00064 L-Glutamine -120.6 7 0.25 14 298.15 1 Alberty (2006) | |
| C00065 L-Serine -225.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00067 Formaldehyde -40 7 0.25 14 298.15 0 Maden (2000) The value in Alberty (2006) is probably wrong | |
| C00074 Phosphoenolpyruvate -1189.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00078 L-Tryptophan 374.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00079 L-Phenylalanine 241.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C00080 H+ 0 0 0 14 298.15 0 Element | |
| C00082 L-Tyrosine 77.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00084 Acetaldehyde 24 7 0.25 14 298.15 1 Alberty (2006) | |
| C00085 D-Fructose 6-phosphate -1316 7 0.25 14 298.15 1 Alberty (2006) | |
| C00086 Urea -39.8 7 0.25 14 298.15 0 Alberty (2006) | |
| C00088 Nitrite -33 7 0.25 14 298.15 0 Alberty (2006) | |
| C00087 Sulfur 0 7 0.25 14 298.15 0 Element | |
| C00089 Sucrose -668.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00092 D-Glucose 6-phosphate -1319.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C00093 sn-Glycerol 3-phosphate -1077.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00094 Sulfite -488 7 0.25 14 298.15 0 Alberty (2006) | |
| C00095 D-Fructose -426.6 7 0.25 14 298.15 1 Alberty (2006) | |
| C00097 L-Cysteine -53.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00103 D-Glucose 1-phosphate -1312 7 0.25 14 298.15 1 Alberty (2006) | |
| C00111 Glycerone phosphate -1095.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C00116 Glycerol -171.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00117 D-Ribose 5-phosphate -1232.4 7 0.25 14 298.15 1 Alberty (2006) | |
| C00118 D-Glyceraldehyde 3-phosphate -1088.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00119 5-Phospho-alpha-D-ribose 1-diphosphate -2977.4 7 0.25 14 298.15 1 Alberty (2006) | |
| C00121 D-Ribose -331.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00122 Fumarate -523.6 7 0.25 14 298.15 1 Alberty (2006) | |
| C00123 L-Leucine 177.4 7 0.25 14 298.15 1 Alberty (2006) | |
| C00124 D-Galactose -420 7 0.25 14 298.15 1 Alberty (2006) | |
| C00132 Methanol -12.3 7 0.25 14 298.15 0 Alberty (2006) | |
| C00147 Adenine 517.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C00149 (S)-Malate -682.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C00152 L-Asparagine -200.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C00158 Citrate -966.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00159 D-Mannose -421.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C00160 Glycolate -409.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00164 Acetoacetate -279.6 7 0.25 14 298.15 1 Alberty (2006) | |
| C00181 D-Xylose -343 7 0.25 14 298.15 1 Alberty (2006) | |
| C00183 L-Valine 89.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00184 Glycerone -206.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00186 (S)-Lactate -313.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C00188 L-Threonine -162.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00197 3-Phospho-D-glycerate -1347 7 0.25 14 298.15 1 Alberty (2006) | |
| C00198 D-Glucono-1,5-lactone -496.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C00199 D-Ribulose 5-phosphate -1232 7 0.25 14 298.15 1 Alberty (2006) | |
| C00207 Acetone 84.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C00208 Maltose -678.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00209 Oxalate -677.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C00212 Adenosine 335.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C00216 D-Arabinose -334.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C00218 Methylamine 203.8 7 0.25 14 298.15 0 Alberty (2006) | |
| C00224 Adenylyl sulfate -1056.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00227 Acetyl phosphate -1100.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00233 4-Methyl-2-oxopentanoate -79.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00236 3-Phospho-D-glyceroyl phosphate -2206.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00237 CO -119.9 7 0.25 14 298.15 0 Alberty (2006) | |
| C00243 Lactose -671 7 0.25 14 298.15 1 Alberty (2006) | |
| C00244 Nitrate -109.5 7 0.25 14 298.15 0 Alberty (2006) | |
| C00246 Butanoic acid -68.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00247 L-Sorbose -423 7 0.25 14 298.15 1 Alberty (2006) | |
| C00249 Hexadecanoic acid 1002.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C00252 Isomaltose -691.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00257 D-Gluconic acid -680.9 7 0.25 14 298.15 1 Thauer (1977) | |
| C00258 D-Glycerate -458.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C00262 Hypoxanthine 252.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00275 D-Mannose 6-phosphate -1315 7 0.25 14 298.15 1 Alberty (2006) | |
| C00282 Hydrogen 99.1 7 0.25 14 298.15 0 Alberty (2006) | |
| C00283 Hydrogen sulfide 51.5 7 0.25 14 298.15 0 Alberty (2006) | |
| C00288 CO2(tot) -547 7 0.25 14 298.15 0 Alberty (2006) | |
| C00294 Inosine 79.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00300 Creatine 107.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00305 Magnesium cation -458.5 7 0.25 14 298.15 0 Alberty (2006) | |
| C00309 D-Ribulose -328.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00310 D-Xylulose -338.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00311 Isocitrate -959.6 7 0.25 14 298.15 1 Alberty (2006) | |
| C00354 D-Fructose 1,6-bisphosphate -2207 7 0.25 14 298.15 1 Alberty (2006) | |
| C00366 Urate -194.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C00379 Xylitol -295.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00392 Mannitol -372.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00407 L-Isoleucine 185.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C00417 cis-Aconitate -802.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C00463 Indole 509 7 0.25 14 298.15 1 Alberty (2006) | |
| C00469 Ethanol 62.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C00476 D-Lyxose -341.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00491 L-Cystine -177.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00533 Nitric oxide 86.5 7 0.25 14 298.15 0 Alberty (2006) | |
| C00543 Dimethylamine 321.8 7 0.25 14 298.15 0 Thauer (1977) | |
| C00565 Trimethylamine 443.8 7 0.25 14 298.15 0 Thauer (1977) | |
| C00575 3',5'-Cyclic AMP -343.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C00577 D-Glyceraldehyde -195.6 7 0.25 14 298.15 1 Alberty (2006) | |
| C00620 alpha-D-Ribose 1-phosphate -1224.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C00631 2-Phospho-D-glycerate -1340.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00636 D-Mannose 1-phosphate -1309.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00644 D-Mannitol 1-phosphate -1267.4 7 0.25 14 298.15 1 Alberty (2006) | |
| C00673 2-Deoxy-D-ribose 5-phosphate -1084.6 7 0.25 14 298.15 1 Alberty (2006) | |
| C00697 Nitrogen 18.7 7 0.25 14 298.15 0 Alberty (2006) | |
| C00791 Creatinine 261.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C00794 D-Sorbitol -375.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C00849 Ethyl acetate -11.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C00887 Nitrous oxide 104.2 7 0.25 14 298.15 0 Alberty (2006) | |
| C01005 O-Phospho-L-serine -1119.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C01013 3-Hydroxypropanoate -315.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C01083 alpha,alpha-Trehalose -686.4 7 0.25 14 298.15 1 Alberty (2006) | |
| C01096 Sorbitol 6-phosphate -1266.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C01112 D-Arabinose 5-phosphate -1235 7 0.25 14 298.15 1 Alberty (2006) | |
| C01113 D-Galactose 6-phosphate -1312 7 0.25 14 298.15 1 Alberty (2006) | |
| C01127 4-Hydroxy-2-oxoglutarate -812 7 0.25 14 298.15 1 Alberty (2006) | |
| C01236 D-Glucono-1,5-lactone 6-phosphate -1382.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C01326 Hydrogen cyanide 160.3 7 0.25 14 298.15 0 Wagman (1982) | |
| C01353 Carbonic acid -546.8 7 0.25 14 298.15 0 Alberty (2006) | |
| C01384 Maleic acid -513.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C01412 Butanal 196.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C01417 Cyanate -98.2 7 0.25 14 298.15 0 Alberty (2006) | |
| C01438 Methane 128.6 7 0.25 14 298.15 0 Alberty (2006) | |
| C01507 L-Iditol -374.3 7 0.25 14 298.15 1 Alberty (2006) | |
| C01755 Thiocyanate 91.8 7 0.25 14 298.15 0 Wagman (1982) | |
| C01845 Propan-2-ol 140.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C02037 Glycylglycine -194.6 7 0.25 14 298.15 1 Alberty (2006) | |
| C02226 2-Methylmaleate -441 7 0.25 14 298.15 1 Alberty (2006) | |
| C02271 Dichloromethane 15.4 7 0.25 14 298.15 0 Dolfing (1994) | |
| C02357 2-Chlorobenzoate -75.7 7 0.25 14 298.15 1 Dolfing (1992) | |
| C02359 2-Fluorobenzoate -236.5 7 0.25 14 298.15 1 Dolfing (1992) | |
| C02364 3-Fluorobenzoate -231 7 0.25 14 298.15 1 Dolfing (1992) | |
| C02370 4-Chlorobenzoate -77.3 7 0.25 14 298.15 1 Dolfing (1992) | |
| C02371 4-Fluorobenzoate -226 7 0.25 14 298.15 1 Dolfing (1992) | |
| C02612 (R)-2-Methylmalate -602.7 7 0.25 14 298.15 1 Alberty (2006) | |
| C03196 (S)-2-Hydroxyglutarate -599 7 0.25 14 298.15 1 Alberty (2006) | |
| C03232 3-Phosphonooxypyruvate -1374.5 7 0.25 14 298.15 1 Alberty (2006) | |
| C03383 D-Galactono-1,4-lactone -497.9 7 0.25 14 298.15 1 Alberty (2006) | |
| C03384 D-Galactose 1-phosphate -1311.8 7 0.25 14 298.15 1 Alberty (2006) | |
| C05361 Hydrazine 290.9 7 0.25 14 298.15 0 Thauer (1977) | |
| C05572 4-Oxoglutaramate -352.2 7 0.25 14 298.15 1 Alberty (2006) | |
| C05979 Propane-1-ol 150.1 7 0.25 14 298.15 1 Alberty (2006) | |
| C05984 2-Hydroxybutanoic acid -221.9 7 0.25 14 298.15 1 Thauer (1977) | |
| C06142 1-Butanol 235.6 7 0.25 14 298.15 1 Alberty (2006) | |
| C06547 Ethylene 244.4 7 0.25 14 298.15 1 Dolfing (1994) | |
| C06670 2,4-Dichlorobenzoate -155 7 0.25 14 298.15 1 Dolfing (1992) | |
| C06752 1,2-Dichloroethane 90 7 0.25 14 298.15 1 Dolfing (1994) | |
| C06789 Tetrachloroethene 27.6 7 0.25 14 298.15 1 Dolfing (1994) | |
| C06790 Trichloroethene 66.2 7 0.25 14 298.15 1 Dolfing (1994) | |
| C06791 trans-1,2-Dichloroethene 113.5 7 0.25 14 298.15 1 Dolfing (1994) | |
| C06792 cis-1,2-Dichloroethene 109.3 7 0.25 14 298.15 1 Dolfing (1994) | |
| C06793 Vinyl chloride 181.9 7 0.25 14 298.15 1 Dolfing (1994) | |
| C07561 Carbon tetrachloride -45.1 7 0.25 14 298.15 0 Dolfing (1994) | |
| C09306 Sulfur dioxide -300.7 7 0.25 14 298.15 0 Thauer (1977) | |
| C13827 Chloroform -25.8 7 0.25 14 298.15 0 Dolfing (1994) | |
| C14039 1,1-Dichloroethylene 113.7 7 0.25 14 298.15 1 Dolfing (1994) | |
| C14400 1,2,3-Trichloropropane 103.2 7 0.25 14 298.15 1 Dolfing (1994) | |
| C14705 1,1,1,2-Tetrachloroethane 3.7 7 0.25 14 298.15 1 Dolfing (1994) | |
| C14818 Fe2+ -82.1 7 0.25 14 298.15 0 Thauer (1977) | |
| C14819 Fe3+ -11.9 7 0.25 14 298.15 0 Thauer (1977) | |
| C18246 1,1,1-Trichloroethane 53.2 7 0.25 14 298.15 1 Dolfing (1994) | |
| C18247 1,1-Dichloroethane 94.3 7 0.25 14 298.15 1 Dolfing (1994) | |
| C18248 Chloroethane 166.9 7 0.25 14 298.15 1 Dolfing (1994) | |
| C19034 1,2-Dichloropropane 164.6 7 0.25 14 298.15 1 Dolfing (1994) | |
| C19248 Hexachloroethane -49.6 7 0.25 14 298.15 1 Dolfing (1994) | |
| C19496 Pentachloroethane -27.5 7 0.25 14 298.15 1 Dolfing (1994) | |
| C19536 1,1,2-Trichloroethane 44.6 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80002 Monochlorobenzene 306 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80003 1,2-Dichlorobenzene 247.3 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80004 1,3-Dichlorobenzene 244.8 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80005 1,4-Dichlorobenzene 241.3 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80006 1,2,3-Trichlorobenzene 193.9 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80007 1,2,4-Trichlorobenzene 182.7 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80008 1,3,5-Trichlorobenzene 179 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80009 1,2,3,4-Tetrachlorobenzene 137.3 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80010 1,2,3,5-Tetrachlorobenzene 130.7 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80011 1,2,4,5-Tetrachlorobenzene 135 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80012 Pentachlorobenzene 86.4 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80013 Hexachlorobenzene 46 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80014 3-Chlorobenzoate -83.8 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80015 2,3-Dichlorobenzoate -148.3 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80016 2,5-Dichlorobenzoate -157.3 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80017 2,6-Dichlorobenzoate -141.2 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80018 3,4-Dichlorobenzoate -142.8 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80019 3,5-Dichlorobenzoate -152.1 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80020 2,3,5-Trichlorobenzoate -212.7 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80021 3,4,5-Trichlorobenzoate -200.9 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80022 2-Bromobenzoate -47.3 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80023 3-Bromobenzoate -40.8 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80024 4-Bromobenzoate -34.1 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80025 2-Iodobenzoate 15.7 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80026 3-Iodobenzoate 18.1 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80027 4-Iodobenzoate 20.9 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80028 2-Amino-5-chlorobenzoate -12.6 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80029 2-Hydroxy-5-chlorobenzoate -246.7 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80030 2-Methyl-5-chlorobenzoate 6.6 7 0.25 14 298.15 1 Dolfing (1992) | |
| C80043 Chloromethane 69.5 7 0.25 14 298.15 0 Dolfing (1994) | |
| C80045 Ethane 227 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80046 1,1,2,2-Tetrachloroethane -7.4 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80047 Propane 318.6 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80048 1-Chloropropane 240.5 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80049 1,3-Dichloropropane 164.1 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80050 Butane 407.2 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80051 1-Chlorobutane 334.9 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80052 2-Chlorobutane 321.1 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80053 Pentane 498.2 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80054 1-Chloropentane 418.6 7 0.25 14 298.15 1 Dolfing (1994) | |
| C80055 CH3NHp 444 7 0.25 14 298.15 0 Wagman (1982) | |
| C11143 DMSO 0 Placeholder just to tell CC not to try to decompose this compound | |