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1,3,7-trimethylurate

MNXM2761 is deprecated and here replaced by MNXM1368925
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368925 Image of MNXM1368925
referencechebi:691622
formulaC8H10N4O3
global charge0
mol weight210.193
InChIKeyBYXCFUMGEBZDDI-UHFFFAOYSA-N
InChIInChI=1S/C8H10N4O3/c1-10-4-5(9-7(10)14)11(2)8(15)12(3)6(4)13/h1-3H3,(H,9,14)
SMILESCN1C(=O)C2=C(NC(=O)N2C)N(C)C1=O
MNX internals
InChI (mnx)InChI=1/C8H10N4O3/c1-10-4-5(9-7(10)14)11(2)8(15)12(3)6(4)13/h1-3H3,(H,9,14) Image of MNXM1368925
SMILES (mnx)[CH3:1][N:10]1[C:4]2=[C:5]([N:9]=[C:7]1[OH:14])[N:11]([CH3:2])[C:8](=[O:15])[N:12]([CH3:3])[C:6]2=[O:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:691622
chebi:691622
BYXCFUMGEBZDDI-UHFFFAOYSA-N 		1,3,7-trimethylurate
1,3,7-trimethyl-2,3,6,7,8,9-hexahydro-1H-purine-2,6,8-trione
1,3,7-trimethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione
1,3,7-trimethyluric acid
7,9-dihydro-1,3,7-trimethyl-1H-purine-2,6,8(3H)-trione
8-oxocaffeine
8-oxy-caffeine

envipath:...09807889c5ea
envipathM:...09807889c5ea
BYXCFUMGEBZDDI-UHFFFAOYSA-N 		1,3,7-Trimethyluric acid
hmdb:HMDB0002123
BYXCFUMGEBZDDI-UHFFFAOYSA-N 		1,3,7-Trimethyluric acid
1,3, 7-Trimethyluric acid
1,3,7-Trimethyl-2,3,6,7,8,9-hexahydro-1H-purine-2,6,8-trione
1,3,7-Trimethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione
1,3,7-Trimethylate
1,3,7-Trimethylic acid
1,3,7-Trimethylurate
1,3,7-trimethyl-2,3,6,7,8,9-hexahydro-1H-purine-2,6,8-trione
1,3,7-trimethyluric acid
2,6,8-Trihydroxy-1,3,7-trimethylpurine
7,9-Dihydro-1,3,7-trimethyl-1H-purine-2,6,8(3H)-trione
8-Hydroxy-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
8-Oxocaffeine
8-Oxy-caffeine
Trimethyl uric acid

kegg.compound:C16361
keggC:C16361
BYXCFUMGEBZDDI-UHFFFAOYSA-N 		1,3,7-Trimethyluric acid
1,3,7-Trimethylurate

metacyc.compound:CPD-12480
metacycM:CPD-12480
BYXCFUMGEBZDDI-UHFFFAOYSA-N 		1,3,7-trimethylurate
1,3,7-trimethyluric acid

envipath:...6df9d6d7d39e
envipathM:...6df9d6d7d39e
BYXCFUMGEBZDDI-UHFFFAOYSA-N 		compound 0062103

hmdb:HMDB02123
keggC:M_C16361 		secondary/obsolete/fantasy identifier