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3-methylxanthine

PropertiesImageOccurences in reactions
MNX_IDMNXM1890Image of MNXM1890
#reac
in my sandbox 0
in MNXref (generic)15
in models (compartimentalized) 0
formulaC6H6N4O2
charge0
mass166.04908
referencechebi:62208
InChIKeyGMSNIKWWOQHZGF-UHFFFAOYSA-N
InChIInChI=1S/C6H6N4O2/c1-10-4-3(7-2-8-4)5(11)9-6(10)12/h2H,1H3,(H,7,8)(H,9,11,12)
SMILESCn1c(=O)[nH]c(=O)c2[nH]cnc21
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:62208
chebi:62208
3-methylxanthine
3,7-dihydro-3-methyl-1H-purine-2,6-dione
3-methyl-3,7(9)-dihydro-purine-2,6-dione
3-methyl-3,7-dihydro-1H-purine-2,6-dione
3-methyl-7H-xanthine
N(1)-demethyltheophylline
envipath:...cabf19578c5c
envipathM:...cabf19578c5c
kegg.compound:C16357
keggC:C16357
3-Methylxanthine
hmdb:HMDB0001886 3-Methylxanthine
2,6-Dihydroxy-3-methylpurine
2-oxo-3-Methylhypoxanthine
3 MX
3,9-Dihydro-3-methyl-1H-purine-2,6-dione
3-Methyl xanthine
3-Methyl-3,7(9)-dihydro-purine-2,6-dione
3-Methyl-3,9-dihydro-2H,6H-purine-2,6-dione
3-Methyl-3,9-dihydro-purine-2,6-dione
3-Methylxanthine, methyl-(13)C-labeled
3-Methylxanthine, monopotassium salt
3-Methylxanthine, monosodium salt
3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
3-methylxanthine
Purine analog
seed.compound:cpd15073
seedM:cpd15073
3-Methylxanthine
3-methylxanthine
CHEBI:62207
chebi:62207
3-methyl-9H-xanthine
2-oxo-3-methylhypoxanthine
3 MX
3,9-dihydro-3-methyl-1H-purine-2,6-dione
3-Methylxanthine
3-methyl-3,7(9)-dihydro-purine-2,6-dione
3-methyl-3,9-dihydro-1H-purine-2,6-dione
3-methyl-3,9-dihydro-2H,6H-purine-2,6-dione
metacyc.compound:3-METHYLXANTHINE
metacycM:3-METHYLXANTHINE
3-methylxanthine
CHEBI:62205
chebi:62205
3-methylxanthine
3-methylxanthines
hmdb:HMDB01886
keggC:M_C16357
seedM:M_cpd15073
secondary/obsolete/fantasy identifier