MTQ00001 Water H2O H2O 0 Self _ _ _ 15377

MTQ00002 Nitrogen N2_ N2 0 Self _ _ _ 17997

MTQ00003 Dioxygen O2_ O2 0 Self _ _ _ 15379

MTQ00004 Superoxide anion O2Rd O2 -1 MTQ00003 _ _ _ 18421

MTQ00005 Hydrogen H2_ H2 0 Self _ _ _ 18276

MTQ00006 Proton H__ H 1 MTQ00005 _ _ _ 24636

MTQ00007 Hydroxide OH_ HO -1 MTQ00001 _ _ _ 16234

MTQ00008 Formaldehyde HCHO CH2O 0 Self _ _ _ 16842

MTQ00009 Carbon dioxide CO2 CO2 0 Self _ _ _ 16526

MTQ00010 Hydrogencarbonate HCO3 CHO3 -1 MTQ00009 _ _ _ 17544

MTQ00011 Carbonic acid H2CO3 CH2O3 0 MTQ00009 _ _ _ 28976

MTQ00012 Carbonate CO3 CO3 -2 MTQ00011 _ _ _ 41609

MTQ00013 Ammonia NH3 H3N 0 Self _ _ _ 16134

MTQ00014 Ammonium NH4 H4N 1 MTQ00013 _ _ _ 28938

MTQ00015 Hydrogen peroxide H2O2 H2O2 0 Self _ _ _ 16240

MTQ00024 Nitrous oxide N2O N2O 0 Self _ _ _ 17045

MTQ00025 Nitric oxide NO_ NO 0 Self _ _ _ 16480

MTQ00016 Phosphate(3-) Pi_ O4P -3 Self _ _ _ 18367

MTQ00017 Pyrophosphate(4-) PPi O7P2 -4 Self _ _ _ 18361

MTQ00019 Inorganic Sulfate SO4 O4S -2 Self _ _ _ 16189

MTQ00020 Inorganic sulfite SO3 O3S -2 Self _ _ _ 17359

MTQ00021 Sulfide(2-) S__ S -2 Self _ _ _ 15138

MTQ00022 Nitrate NO3 NO3 -1 Self _ _ _ 17632

MTQ00023 Nitrite NO2 NO2 -1 Self _ _ _ 16301

MTQ00026 Molybdate MoO4 MoO4 -2 Self _ _ _ 36264

MTQ00027 Sodium(1+) Na1 Na 1 Self _ _ _ 29101

MTQ00028 Potassium(1+) K1_ K 1 Self _ _ _ 29103

MTQ00029 Magnesium(2+) Mg2 Mg 2 Self _ _ _ 18420

MTQ00030 Calcium(2+) Ca2 Ca 2 Self _ _ _ 29108

MTQ00031 Manganese(2+) Mn2 Mn 2 Self _ _ _ 29035

MTQ00032 Iron(2+) Fe2 Fe 2 Self _ _ _ 29033

MTQ00033 Iron(3+) Fe3 Fe 3 MTQ00032 _ _ _ 29034

MTQ00034 Cobalt(2+) Co2 Co 2 Self _ _ _ 48828

MTQ00035 Nickel(2+) Ni2 Ni 2 Self _ _ _ 49786

MTQ00036 Copper(2+) Cu2 Cu 2 Self _ _ _ 29036

MTQ00037 Zinc(2+) Zn2 Zn 2 Self _ _ _ 29105

MTQ00038 Chloride Cl_ Cl -1 Self _ _ _ 17996

MTQ00039 Vanadate(3-) VO4 O4V -3 Self _ _ _ 46442

MTQ00040 Selenite(2-) SeO3 O3Se -2 Self _ _ _ 18212

MTQ00041 Electron e__ none -1 Self _ _ _ 10545

MTQ00042 Photon hv_ none 0 Self _ _ _ 30212

MTQ00043 Methanol MeOH CH4O 0 Self _ _ _ 17790

MTQ00044 Ethanol EtOH C2H6O 0 Self _ _ _ 16236

MTQ00045 Isopropanol IPA C3H8O 0 Self _ _ _ 17824

MTQ00046 Acetone Ace C3H6O 0 Self _ _ _ 15347

MTQ00047 Urea UREA CH4N2O 0 Self _ _ _ 16199

MTQ00018 Polyphosphate polyPi (O3P)nHO unspecified Self _ _ G 16838

MTQ00048 Glycine Gly C2H5NO2 0 Self _ _ _ 15428

MTQ00049 L-Alanine Ala C3H7NO2 0 Self _ _ _ 16977

MTQ00050 L-Valine Val C5H11NO2 0 Self _ _ _ 16414

MTQ00051 L-Leucine Leu C6H13NO2 0 Self _ _ _ 15603

MTQ00052 L-Isoleucine Ile C6H13NO2 0 Self _ _ _ 17191

MTQ00053 L-Methionine Met C5H11NO2S 0 Self _ _ _ 16643

MTQ00054 L-Proline Pro C5H9NO2 0 Self _ _ _ 17203

MTQ00055 L-Phenylalanine Phe C9H11NO2 0 Self _ _ _ 17295

MTQ00056 L-Tryptophan Trp C11H12N2O2 0 Self _ _ _ 16828

MTQ00057 L-Serine Ser C3H7NO3 0 Self _ _ _ 17115

MTQ00058 L-Threonine Thr C4H9NO3 0 Self _ _ _ 16857

MTQ00059 L-Asparagine Asn C4H8N2O3 0 Self _ _ _ 17196

MTQ00060 L-Glutamine Gln C5H10N2O3 0 Self _ _ _ 18050

MTQ00061 L-Tyrosine Tyr C9H11NO3 0 Self _ _ _ 17895

MTQ00062 L-Cysteine Cys C3H7NO2S 0 Self _ _ _ 17561

MTQ00063 L-Lysine Lys C6H14N2O2 0 Self _ _ _ 18019

MTQ00064 L-Arginine Arg C6H14N4O2 0 Self _ _ _ 16467

MTQ00065 L-Histidine His C6H9N3O2 0 Self _ _ _ 15971

MTQ00066 L-Aspartate(1-) Asp C4H6NO4 -1 Self _ _ _ 29991

MTQ00067 L-Glutamate(1-) Glu C5H8NO4 -1 Self _ _ _ 29985

MTQ00068 L-Cystine Cys2 C6H12N2O4S2 0 MTQ00062 _ _ _ 16283

MTQ00069 L-Homocysteine Hcy C4H9NO2S 0 Self _ _ _ 17588

MTQ00070 L-Homoserine Hse C4H9NO3 0 Self _ _ _ 15699

MTQ00071 L-Hydroxyproline Hyp C5H9NO3 0 Self _ _ _ 18095

MTQ00072 L-Ornithine Orn C5H12N2O2 0 Self _ _ _ 15729

MTQ00073 beta-Alanine bAla C3H7NO2 0 Self _ _ _ 16958

MTQ00074 Gamma-aminobutyric acid GABA C4H9NO2 0 Self _ _ _ 16865

MTQ00075 D-Alanine DAla C3H7NO2 0 MTQ00049 _ _ _ 15570

MTQ00076 D-Glutamate(1-) DGlu C5H8NO4 -1 MTQ00067 _ _ _ 29986

MTQ00077 Agmatine Agm C5H14N4 0 Self _ _ _ 17431

MTQ00078 Spermidine Spd C7H19N3 0 Self _ _ _ 16610

MTQ00079 Thymine Thy C5H6N2O2 0 Self _ _ _ 17821

MTQ00080 Uracil Ura C4H4N2O2 0 Self _ _ _ 17568

MTQ00081 Cytosine Cyt C4H5N3O 0 Self _ _ _ 16040

MTQ00082 Adenine Ade C5H5N5 0 Self _ _ _ 16708

MTQ00083 Guanine Gua C5H5N5O 0 Self _ _ _ 16235

MTQ00084 Hypoxanthine Hyp C5H4N4O 0 Self _ _ _ 17368

MTQ00085 Xanthine Xan C5H4N4O2 0 Self _ _ _ 48517

MTQ00086 Uridine Urd C9H12N2O6 0 Self _ _ _ 16704

MTQ00087 Cytidine Cyd C9H13N3O5 0 Self _ _ _ 17562

MTQ00088 Adenosine Ado C10H13N5O4 0 Self _ _ _ 16335

MTQ00089 Guanosine Guo C10H13N5O5 0 Self _ _ _ 16750

MTQ00090 Inosine Ino C10H12N4O5 0 Self _ _ _ 17596

MTQ00091 Thymidine dThd C10H14N2O5 0 Self _ _ _ 17748

MTQ00092 Deoxyuridine dUrd C9H12N2O5 0 Self _ _ _ 16450

MTQ00093 Deoxycytidine dCyd C9H13N3O4 0 Self _ _ _ 15698

MTQ00094 Deoxyadenosine dAdo C10H13N5O3 0 Self _ _ _ 17256

MTQ00095 Deoxyguanosine dGuo C10H13N5O4 0 Self _ _ _ 17172

MTQ00096 UMP UMP C9H13N2O9P 0 Self _ _ _ 16695

MTQ00097 UDP UDP C9H14N2O12P2 0 Self _ _ _ 17659

MTQ00098 UTP UTP C9H15N2O15P3 0 Self _ _ _ 15713

MTQ00099 CMP CMP C9H14N3O8P 0 Self _ _ _ 17361

MTQ00100 CDP CDP C9H15N3O11P2 0 Self _ _ _ 17239

MTQ00101 CTP CTP C9H16N3O14P3 0 Self _ _ _ 17677

MTQ00102 AMP AMP C10H14N5O7P 0 Self _ _ _ 16027

MTQ00103 ADP ADP C10H15N5O10P2 0 Self _ _ _ 16761

MTQ00104 ATP ATP C10H16N5O13P3 0 Self _ _ _ 15422

MTQ00105 GMP GMP C10H14N5O8P 0 Self _ _ _ 17345

MTQ00106 GDP GDP C10H15N5O11P2 0 Self _ _ _ 17552

MTQ00107 GTP GTP C10H16N5O14P3 0 Self _ _ _ 15996

MTQ00108 IMP IMP C10H13N4O8P 0 Self _ _ _ 17202

MTQ00109 IDP IDP C10H14N4O11P2 0 Self _ _ _ 17808

MTQ00110 ITP ITP C10H15N4O14P3 0 Self _ _ _ 16039

MTQ00111 XMP XMP C10H13N4O9P 0 Self _ _ _ 15652

MTQ00112 XDP XDP C10H14N4O12P2 0 Self _ _ _ 10048

MTQ00113 XTP XTP C10H15N4O15P3 0 Self _ _ _ 10049

MTQ00116 NMP NMP C5H10O7PR 0 Self _ _ G 17188

MTQ00115 NDP NDP C5H11O10P2R 0 Self _ _ G 16862

MTQ00114 NTP NTP C5H12O13P3R 0 Self _ _ G 17326

MTQ00117 dTMP dTMP C10H15N2O8P 0 Self _ _ _ 17013

MTQ00118 dTDP dTDP C10H16N2O11P2 0 Self _ _ _ 18075

MTQ00119 dTTP dTTP C10H17N2O14P3 0 Self _ _ _ 18077

MTQ00120 dUMP dUMP C9H13N2O8P 0 Self _ _ _ 17622

MTQ00121 dUDP dUDP C9H14N2O11P2 0 Self _ _ _ 28850

MTQ00122 dUTP dUTP C9H15N2O14P3 0 Self _ _ _ 17625

MTQ00123 dCMP dCMP C9H14N3O7P 0 Self _ _ _ 15918

MTQ00124 dCDP dCDP C9H15N3O10P2 0 Self _ _ _ 28846

MTQ00125 dCTP dCTP C9H16N3O13P3 0 Self _ _ _ 16311

MTQ00126 dAMP dAMP C10H14N5O6P 0 Self _ _ _ 17713

MTQ00127 dADP dADP C10H15N5O9P2 0 Self _ _ _ 16174

MTQ00128 dATP dATP C10H16N5O12P3 0 Self _ _ _ 16284

MTQ00129 dGMP dGMP C10H14N5O7P 0 Self _ _ _ 16192

MTQ00130 dGDP dGDP C10H15N5O10P2 0 Self _ _ _ 28862

MTQ00131 dGTP dGTP C10H16N5O13P3 0 Self _ _ _ 16497

MTQ00132 3'-UMP 3UMP C9H13N2O9P 0 Self _ _ _ 28895

MTQ00133 3'-CMP 3CMP C9H14N3O8P 0 Self _ _ _ 53013

MTQ00134 3'-AMP 3AMP C10H14N5O7P 0 Self _ _ _ 28931

MTQ00135 3'-GMP 3GMP C10H14N5O8P 0 Self _ _ _ 28072

MTQ00136 2',3'-Cyclic UMP 23cUMP C9H11N2O8P 0 Self _ _ _ 28637

MTQ00137 2',3'-Cyclic CMP 23cCMP C9H12N3O7P 0 Self _ _ _ 27652

MTQ00138 2',3'-Cyclic AMP 23cAMP C10H12N5O6P 0 Self _ _ _ 27844

MTQ00139 2',3'-Cyclic GMP 23cGMP C10H12N5O7P 0 Self _ _ _ 28181

MTQ00140 5'-S-methyl-5'-thioadenosine MTA C11H15N5O3S 0 Self _ _ _ 17509

MTQ00141 5'-Adenylyl sulfate APS C10H14N5O10PS 0 Self _ _ _ 17709

MTQ00142 ppGpp ppGpp C10H17N5O17P4 0 Self _ _ _ 17633

MTQ00143 pppGpp pppGpp C10H18N5O20P5 0 Self _ _ _ 16690

MTQ00144 Glycerone phosphate DHAP C3H7O6P 0 Self _ _ _ 16108

MTQ00145 Butyric acid BTA C4H8O2 0 Self _ _ _ 30772

MTQ00146 Hexanoic acid HexA C6H12O2 0 Self _ _ _ 30776

MTQ00147 Octanoic acid OctA C8H16O2 0 Self _ _ _ 28837

MTQ00148 Triacylglycerol TAG C6H5O6R3 0 Self _ _ G 17855

MTQ00149 D-Glucose Glc C6H12O6 0 Self _ _ _ 4167

MTQ00150 D-Mannose Man C6H12O6 0 Self _ _ _ 4208

MTQ00151 D-Galactose Gal C6H12O6 0 Self _ _ _ 4139

MTQ00152 D-Fructose Fru C6H12O6 0 Self _ _ _ 15824

MTQ00153 D-Ribose Rib C5H10O5 0 Self _ _ _ 47013

MTQ00154 Glycerol Gly C3H8O3 0 Self _ _ _ 17754

MTQ00155 Sucrose Suc C12H22O11 0 Self _ _ _ 17992

MTQ00156 Maltose Mlt C12H22O11 0 Self _ _ _ 17306

MTQ00157 Lactose Lac C12H22O11 0 Self _ _ _ 17716

MTQ00158 D-Glucosamine GlcN C6H13NO5 0 Self _ _ _ 47977

MTQ00159 N-Acetyl-D-glucosamine GlcNAc C8H15NO6 0 Self _ _ _ 506227

MTQ00160 N-Acetyl-D-muramic acid MurNAc C11H19NO8 0 Self _ _ _ 21615

MTQ00161 N-Acetyl-D-galactosamine GalNAc C8H15NO6 0 Self _ _ _ 28037

MTQ00162 Myo-Inositol MyoIno C6H12O6 0 Self _ _ _ 17268

MTQ00163 D-Ribose 5-phosphate R5P C5H11O8P 0 Self _ _ _ 52742

MTQ00164 D-Ribulose 5-phosphate Ru5P C5H11O8P 0 Self _ _ _ 17363

MTQ00165 PRPP PRPP C5H13O14P3 0 Self _ _ _ 17111

MTQ00166 D-Glyceraldehyde 3-phosphate GAP C3H7O6P 0 Self _ _ _ 29052

MTQ00167 Formate Fmt CHO2 -1 Self _ _ _ 15740

MTQ00168 Acetate AcO C2H3O2 -1 Self _ _ _ 30089

MTQ00169 Propanoate Prop C3H5O2 -1 Self _ _ _ 17272

MTQ00170 D-Glycerate Gryc C3H5O4 -1 Self _ _ _ 16659

MTQ00171 Acetoacetate AcAc C4H5O3 -1 Self _ _ _ 13705

MTQ00172 Valerate Vale C5H9O2 -1 Self _ _ _ 31011

MTQ00173 Heptanoate HEP C7H13O2 -1 Self _ _ _ 32362

MTQ00174 Phosphoenolpyruvate PEP C3H4O6P -1 Self _ _ _ 18021

MTQ00175 5-Aminolevulinate 5ALA C5H8NO3 -1 Self _ _ _ 12109

MTQ00176 Oxalate(2-) Oxa C2O4 -2 Self _ _ _ 30623

MTQ00177 Malonate(2-) Mlo C3H2O4 -2 Self _ _ _ 15792

MTQ00178 Succinate(2-) SUCC C4H4O4 -2 Self _ _ _ 30031

MTQ00179 Fumarate(2-) FUM C4H2O4 -2 Self _ _ _ 29806

MTQ00180 (S)-malate(2-) MAL C4H4O5 -2 Self _ _ _ 15589

MTQ00181 Glutarate(2-) Glut C5H6O4 -2 Self _ _ _ 30921

MTQ00182 Adipate(2-) Adip C6H8O4 -2 Self _ _ _ 17128

MTQ00183 Pimelate(2-) PML C7H10O4 -2 Self _ _ _ 36165

MTQ00184 Suberate(2-) SUBR C8H12O4 -2 Self _ _ _ 76282

MTQ00185 Citrate(3-) CIT C6H5O7 -3 Self _ _ _ 16947

MTQ00186 Isocitrate(3-) ICIT C6H5O7 -3 Self _ _ _ 16087

MTQ00187 cis-Aconitate(3-) Acon C6H3O6 -3 Self _ _ _ 16383

MTQ00188 Glyoxylate Glyox C2HO3 -1 Self _ _ _ 36655

MTQ00189 Pyruvate PYR C3H3O3 -1 Self _ _ _ 15361

MTQ00190 Oxaloacetate(2-) OAC C4H2O5 -2 Self _ _ _ 16452

MTQ00191 2-Oxobutanoate 2OB C4H5O3 -1 Self _ _ _ 16763

MTQ00192 2-Oxoglutarate(2-) 2OG C5H4O5 -2 Self _ _ _ 16810

MTQ00193 2-Oxopentanoate 2OPA C5H7O3 -1 Self _ _ _ 28644

MTQ00194 2-Oxohexanoate Oxoh C6H9O3 -1 Self _ _ _ 35177

MTQ00195 NAD(+) NAD C21H28N7O14P2 1 Self _ _ _ 15846

MTQ00196 NADH NADH C21H29N7O14P2 0 MTQ00195 _ _ _ 16908

MTQ00197 NADP(+) NADP C21H29N7O17P3 1 Self _ _ _ 18009

MTQ00198 NADPH NADPH C21H30N7O17P3 0 MTQ00197 _ _ _ 16474

MTQ00199 NMN NMN C11H15N2O8P 0 Self _ _ _ 16171

MTQ00200 FAD FADox C27H33N9O15P2 0 Self _ _ _ 16238

MTQ00201 FADH(.) FADHRd C27H34N9O15P2 0 MTQ00200 _ _ _ 30788

MTQ00202 FADH2 FADH2 C27H35N9O15P2 0 MTQ00200 _ _ _ 17877

MTQ00203 FMN FMNox C17H21N4O9P 0 Self _ _ _ 17621

MTQ00204 FMNH(.) FMNHRd C17H22N4O9P 0 MTQ00203 _ _ _ 50528

MTQ00205 FMNH2 FMNH2 C17H23N4O9P 0 MTQ00203 _ _ _ 16048

MTQ00206 S-Adenosyl-L-methionine SAM C15H23N6O5S 1 Self _ _ _ 15414

MTQ00207 S-Adenosyl-L-homocysteine SAH C14H20N6O5S 0 Self _ _ _ 16680

MTQ00208 Coenzyme A CoA C21H36N7O16P3S 0 Self _ _ _ 15346

MTQ00209 Acetyl-CoA AcCoA C23H38N7O17P3S 0 Self _ _ _ 15351

MTQ00210 Succinyl-CoA SucCoA C25H40N7O19P3S 0 Self _ _ _ 15380

MTQ00211 UDP-glucose UDPGlc C15H24N2O17P2 0 Self _ _ _ 18066

MTQ00212 THF THF C19H23N7O6 0 Self _ _ _ 15635

MTQ00213 5,10-Methylene-THF MTHF C20H23N7O6 0 MTQ00212 _ _ _ 1989

MTQ00214 5,10-Methenyl-THF 510CHTHF C20H22N7O6 1 MTQ00212 _ _ _ 15638

MTQ00215 10-Formyl-THF 10fTHF C20H21N7O7 0 MTQ00212 _ _ _ 15637

MTQ00216 Thiamine Thi C12H17N4OS 1 Self _ _ _ 18385

MTQ00217 Thiamine monophosphate ThMP C12H18N4O4PS 1 MTQ00216 _ _ _ 9533

MTQ00218 Thiamine diphosphate ThDP C12H19N4O7P2S 1 MTQ00216 _ _ _ 9532

MTQ00219 Thiamine triphosphate ThTP C12H20N4O10P3S 1 MTQ00216 _ _ _ 9534

MTQ00220 Riboflavin RbF C17H20N4O6 0 Self _ _ _ 17015

MTQ00221 Biotin Biotin C10H16N2O3S 0 Self _ _ _ 15956

MTQ00222 Pyridoxal 5'-phosphate PLP C8H10NO6P 0 Self _ _ _ 18405

MTQ00223 Menaquinone MKn (C5H8)nC11H8O2 0 Self T _ G 16374

MTQ00224 Menaquinone-8 MK8 C51H72O2 0 MTQ00223 T R _ 44027

MTQ00225 Heme B HemeB C34H32FeN4O4 0 Self _ _ _ 17627