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Substance
ID:1844096
Structure
Similarity
Functional Group
Text
ID:103408
1-methyl-7H-xanthine
Chemical Entities of Biological Interest
ID: CHEBI:68444
Names and Identifiers
IUPAC name
1-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
IUPAC Traditional name
1-methylxanthine
Synonyms
1-methyl-7H-xanthine
Registration numbers
CAS Number
6136-37-4
PubChem CID
80220
KEGG ID
C16358
MetaCyc Database
CPD-9025
PubMed Citation Links
22770225
Reaxys Registry
171507
ACToR Database
6136-37-4
BKMS React Database
93590
90546
92333
95759
90184
98069
92595
94389
95532
BRENDA Database
3.2.2.1
2.4.2.22
2.5.1.6
1.17.3.2
1.14.13.178
1.17.1.4
3.2.2.25
1.14.13.128
1.14.13.179
3.5.4.3
2.1.1.159
2.1.1.160
BRENDA Ligand Database
94389
95532
95759
90184
93590
92595
98069
92333
90546
CHEMBL
CHEMBL1250
CompTox Database
DTXSID30210271
MetaboLights Database
MTBLS926
MTBLS1033
MTBLS1040
MTBLS179
MTBLS20
MTBLS204
MTBLS404
MTBLS290
MTBLS205
SureChEMBL Database
SCHEMBL10996
HMDB Database
HMDB0010738
BindingDB Database
82020
CHEBI ID
CHEBI:68444
PubChem SID
160645813
Properties
No Data Available
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Molecule Details
A 1-methylxanthine tautomer where the imidazole proton is located at the 7-position.
Molecular Spectra
No Data Available
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References
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Molecule Details
Molecular Spectra
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