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Substance Name: 7-Hydroxytheophylline
RN: 1012-82-4
InChIKey: OAJZHQGFGXPEPA-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C7-H8-N4-O3

Molecular Weight

  • 196.1652
 
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Names and Synonyms

Results Name

  • 7-Hydroxytheophylline

Synonyms

  • 5-26-14-00133 (Beilstein Handbook Reference)
  • 7-Hydroxytheophyllin
  • 7-Hydroxytheophyllin [German]
  • 7-Hydroxytheophylline
  • BRN 0616325

Systematic Names

  • 1H-Purine-2,6-dione, 3,7-dihydro-7-hydroxy-1,3-dimethyl- (9CI)
  • Theophylline, 7-hydroxy-

Registry Numbers

CAS Registry Number

  • 1012-82-4

System Generated Number

  • 0001012824

Structure Descriptors

InChI

1S/C7H8N4O3/c1-9-5-4(11(14)3-8-5)6(12)10(2)7(9)13/h3,14H,1-2H3

InChIKey

OAJZHQGFGXPEPA-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)n(cn2)O