1.0 2011-09-21 00:11:50 UTC 2015-10-09 22:32:41 UTC FDB022305 7-Methylguanine 7-Methylguanine is a metabolite of DNA methylation and depurination observed in normal human biofluids; however, it has been found significantly higher in the urine of smokers than in nonsmokers. (PMID 16059882) [HMDB] 2-amino-1,7-dihydro-7-Methyl-6H-purin-6-one 2-amino-1,7-dihydroxy-7-methyl-6H-purine-6-one 2-Amino-6-hydroxy-7-methylpurine 2-Amino-7-methylhypoxanthine 7-methyl-Guanine 7-methyl-Guanine (8CI) 7-Methylguanine N-Methylguanine N(7)-Methylguanine N7-Methylguanine C6H7N5O 165.1527 165.065059871 2-amino-7-methyl-6,7-dihydro-3H-purin-6-one 2-amino-7-methylhypoxanthine 578-76-7 CN1C=NC2=C1C(=O)N=C(N)N2 InChI=1S/C6H7N5O/c1-11-2-8-4-3(11)5(12)10-6(7)9-4/h2H,1H3,(H3,7,9,10,12) FZWGECJQACGGTI-UHFFFAOYSA-N belongs to the class of organic compounds known as hypoxanthines. Hypoxanthines are compounds containing the purine derivative 1H-purin-6(9H)-one. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring. Hypoxanthines Organic compounds Organoheterocyclic compounds Imidazopyrimidines Purines and purine derivatives Aromatic heteropolycyclic compounds 6-oxopurines Aminopyrimidines and derivatives Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives N-substituted imidazoles Organic oxides Organooxygen compounds Organopnictogen compounds Primary amines Pyrimidones Vinylogous amides 6-oxopurine Amine Aminopyrimidine Aromatic heteropolycyclic compound Azacycle Azole Heteroaromatic compound Hydrocarbon derivative Hypoxanthine Imidazole N-substituted imidazole Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary amine Pyrimidine Pyrimidone Vinylogous amide 7-methylguanine Solid logp -0.62 ALOGPS logs -1.43 ALOGPS solubility 6.12e+00 g/l ALOGPS logp -0.37 ChemAxon pka_strongest_acidic 9.35 ChemAxon pka_strongest_basic 2.07 ChemAxon iupac 2-amino-7-methyl-6,7-dihydro-3H-purin-6-one ChemAxon average_mass 165.1527 ChemAxon mono_mass 165.065059871 ChemAxon smiles CN1C=NC2=C1C(=O)N=C(N)N2 ChemAxon formula C6H7N5O ChemAxon inchi InChI=1S/C6H7N5O/c1-11-2-8-4-3(11)5(12)10-6(7)9-4/h2H,1H3,(H3,7,9,10,12) ChemAxon inchikey FZWGECJQACGGTI-UHFFFAOYSA-N ChemAxon polar_surface_area 85.3 ChemAxon refractivity 43.8 ChemAxon polarizability 15.41 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 5 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 952 Specdb::MsIr 953 Specdb::MsIr 954 Specdb::CMs 2766 Specdb::CMs 132817 Specdb::CMs 140551 Specdb::NmrOneD 145730 Specdb::NmrOneD 145731 Specdb::NmrOneD 145732 Specdb::NmrOneD 145733 Specdb::NmrOneD 145734 Specdb::NmrOneD 145735 Specdb::NmrOneD 145736 Specdb::NmrOneD 145737 Specdb::NmrOneD 145738 Specdb::NmrOneD 145739 Specdb::NmrOneD 145740 Specdb::NmrOneD 145741 Specdb::NmrOneD 145742 Specdb::NmrOneD 145743 Specdb::NmrOneD 145744 Specdb::NmrOneD 145745 Specdb::NmrOneD 145746 Specdb::NmrOneD 145747 Specdb::NmrOneD 145748 Specdb::NmrOneD 145749 Specdb::MsMs 1268 Specdb::MsMs 1269 Specdb::MsMs 1270 Specdb::MsMs 4812 Specdb::MsMs 4813 Specdb::MsMs 4814 Specdb::MsMs 4815 Specdb::MsMs 4816 Specdb::MsMs 4817 Specdb::MsMs 4818 Specdb::MsMs 4819 Specdb::MsMs 4820 Specdb::MsMs 4821 Specdb::MsMs 178815 Specdb::MsMs 178816 Specdb::MsMs 178817 Specdb::MsMs 181137 Specdb::MsMs 181138 Specdb::MsMs 181139 Specdb::MsMs 438119 Specdb::MsMs 438120 Specdb::MsMs 438121 Specdb::MsMs 438122 Specdb::MsMs 438123 Specdb::MsMs 446520 HMDB00897 MY6 #<Reference:0x000055ce32bd5b90> #<Reference:0x000055ce32bd5898> #<Reference:0x000055ce32bd55f0> #<Reference:0x000055ce32bd5398> #<Reference:0x000055ce32bd51e0> Anatidae Type 1 specific Anatidae 8830 Beefalo Type 1 specific Bos taurus X Bison bison 297284 Bison Type 1 specific Bison bison 9901 Buffalo Type 1 specific Bubalus bubalis 89462 Cattle (Beef, Veal) Type 1 specific Bos taurus 9913 Chicken Type 1 specific Gallus gallus 9031 Columbidae (Dove, Pigeon) Type 1 specific Columbidae 8930 Deer Type 1 specific Cervidae 9850 Domestic goat Type 1 specific Capra aegagrus hircus 9925 Domestic pig Type 1 specific Sus scrofa domestica 9825 Elk Type 1 specific Cervus canadensis 1574408 Emu Type 1 specific Dromaius novaehollandiae 8790 European rabbit Type 1 specific Oryctolagus 9984 Greylag goose Type 1 specific Anser anser 8843 Guinea hen Type 1 specific Numida meleagris 8996 Horse Type 1 specific Equus caballus 9796 Mallard duck Type 1 specific Anas platyrhynchos 8839 Mountain hare Type 1 specific Lepus timidus 62621 Mule deer Type 1 specific Odocoileus 9871 Ostrich Type 1 specific Struthio camelus 8801 Pheasant Type 1 specific Phasianus colchicus 9054 Quail Type 1 specific Phasianidae 9005 Rabbit Type 1 specific Leporidae 9979 Rock ptarmigan Type 1 specific Lagopus muta 64668 Sheep (Mutton, Lamb) Type 1 specific Ovis aries 9940 Squab Type 1 specific Columba 8931 Turkey Type 1 specific Meleagris gallopavo 9103 Velvet duck Type 1 specific Melanitta fusca 371864 Wild boar Type 1 specific Sus scrofa 9823 DNA-3-methyladenine glycosylase P29372 MPG