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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > heteroarene > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > heteroarene > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > heteroarene > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > heteroarene > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > heteroarene > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > heteroarene > imidazopyrimidine > purines > oxopurine > 1-methyl-3-propyl-7h-xanthine

Preferred term

1-methyl-3-propyl-7h-xanthine  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C9H12N4O2

has_functional_parent

has_role

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

mass

  • 208.221

monoisotopicmass

  • 208.09603

smiles

  • CN1C(=O)C2=C(N=CN2)N(C1=O)CCC

subset

  • 3_STAR

synonym EXACT

  • 1-methyl-3-propyl-3,7-dihydro-1H-purine-2,6-dione

synonym RELATED

  • 1-methyl-3-n-propylxanthine
  • 1-methyl-3-propyl-7H-purine-2,6-dione
  • 1-methyl-3-propylxanthine
  • 3,7-dihydro-1-methyl-3-propyl-1H-purine-2,6-dione
  • MPX

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:145517

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