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caffeine

PropertiesImageOccurences in reactions
MNX_IDMNXM680Image of MNXM680
#reac
in my sandbox 0
in MNXref (generic)26
in models (compartimentalized) 0
formulaC8H10N4O2
charge0
mass194.08038
referencechebi:27732
InChIKeyRYYVLZVUVIJVGH-UHFFFAOYSA-N
InChIInChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3
SMILESCn1c(=O)c2c(ncn2C)n(C)c1=O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
reactome:R-ALL-3296390
reactomeM:R-ALL-3296390
reactome:R-ALL-40727
reactomeM:R-ALL-40727
CHEBI:27732
chebi:27732
caffeine
1,3,7-Trimethylxanthine
1,3,7-trimethyl-2,6-dioxopurine
1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
1,3,7-trimethylpurine-2,6-dione
1,3,7-trimethylxanthine
1-methyltheobromine
3,7-Dihydro-1,3,7-trimethyl-1H-purin-2,6-dion
7-methyltheophylline
CAFFEINE
Caffeine
Coffein
Koffein
Thein
anhydrous caffeine
cafeina
cafeine
guaranine
mateina
methyltheobromine
teina
theine
envipath:...7bc90b829e1c
envipathM:...7bc90b829e1c
Caffeine
kegg.drug:D00528
keggD:D00528
Caffeine (USP)
Anhydrous caffeine (JP18)
Anhydrous caffeine (TN)
Respia (TN)
CHEBI:177330
chebi:177330
Caffeine-D9
1,3,7-tris(trideuteriomethyl)purine-2,6-dione
hmdb:HMDB0001847 Caffeine
1,3,7-Trimethyl-2,6-dioxopurine
1,3,7-Trimethyl-3,7-dihydro-1H-purine-2,6-dione
1,3,7-Trimethylpurine-2,6-dione
1,3,7-Trimethylxanthine
1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
1-Methyl-theobromine
1-Methyltheobromine
3,7-Dihydro-1,3,7-trimethyl-1H-purin-2,6-dion
3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
7-Methyl theophylline
7-Methyltheophylline
Anhydrous caffeine
Anhydrous caffeine (JP15)
Berlin-chemie brand OF caffeine
Bristol-myers squibb brand OF caffeine
Cafeina
Cafeine
Caffedrine
Coffein
Coffeinum N
Coffeinum purrum
Dexitac
Durvitan
GlaxoSmithKline brand OF caffeine
Guaranine
Hycomine
Koffein
Lanorinal
Mateina
Merck dura brand OF caffeine
Methyltheobromide
Methyltheobromine
Methylxanthine theophylline
Monohydrate caffeine
No doz
Passauer brand OF caffeine
Percoffedrinol N
Percutaféine
Pierre fabre brand OF caffeine
Propoxyphene
Quick pep
Quick-pep
QuickPep
Republic drug brand OF caffeine
Respia
Seid brand OF caffeine
Teina
Thein
Theine
Thompson brand 1 OF caffeine
Thompson brand 2 OF caffeine
Vivarin
caffeine
sabiork.compound:9586
sabiorkM:9586
kegg.compound:C07481
keggC:C07481
Caffeine
1,3,7-Trimethylxanthine
seed.compound:cpd04654
seedM:cpd04654
Caffeine
1,3,7-Trimethylxanthine
1,3,7-trimethylxanthine
caffeine
metacyc.compound:1-3-7-TRIMETHYLXANTHINE
metacycM:1-3-7-TRIMETHYLXANTHINE
caffeine
1,3,7-trimethylxanthine
hmdb:HMDB01847
chebi:22982
chebi:3295
chebi:41472
keggC:M_C07481
keggD:M_D00528
seedM:M_cpd04654
secondary/obsolete/fantasy identifier