CHEBI:145517 - 1-methyl-3-propyl-7H-xanthine

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ChEBI Name 1-methyl-3-propyl-7H-xanthine ChEBI ID CHEBI:145517 ChEBI ASCII Name 1-methyl-3-propyl-7H-xanthine Definition An oxopurine that is 1-methyl-7H-xanthine in which the hydrogen attached to the nitrogen at position 3 has been replaced by a propyl group. Stars This entity has been manually annotated by the ChEBI Team. Submitter R. Stephan Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C9H12N4O2 Net Charge 0 Average Mass 208.221 Monoisotopic Mass 208.09603 InChI InChI=1S/C9H12N4O2/c1-3-4-13-7-6(10-5-11-7)8(14)12(2)9(13)15/h5H,3-4H2,1-2H3,(H,10,11) InChIKey MCPROACZLSAAPY-UHFFFAOYSA-N SMILES CN1C(=O)C2=C(N=CN2)N(C1=O)CCC Roles Classification Application(s): bronchodilator agent An agent that causes an increase in the expansion of a bronchus or bronchial tubes. View more via ChEBI Ontology ChEBI Ontology Outgoing 1-methyl-3-propyl-7H-xanthine (CHEBI:145517) has functional parent 1-methyl-7H-xanthine (CHEBI:68444) 1-methyl-3-propyl-7H-xanthine (CHEBI:145517) has functional parent enprofylline (CHEBI:126237) 1-methyl-3-propyl-7H-xanthine (CHEBI:145517) has role bronchodilator agent (CHEBI:35523) 1-methyl-3-propyl-7H-xanthine (CHEBI:145517) is a oxopurine (CHEBI:25810) IUPAC Name 1-methyl-3-propyl-3,7-dihydro-1H-purine-2,6-dione Synonyms Sources 1-methyl-3-n-propylxanthine ChEBI 1-methyl-3-propyl-7H-purine-2,6-dione ChEBI 1-methyl-3-propylxanthine ChEBI 3,7-dihydro-1-methyl-3-propyl-1H-purine-2,6-dione ChemIDplus MPX ChEBI Registry Number Type Source 118024-67-2 CAS Registry Number ChemIDplus Citations Types Sources 2777419 PubMed citation SUBMITTER 3221535 PubMed citation Europe PMC Last Modified 27 November 2019