8-chlorotheophylline
CHEBI:CHEBI_59771
Definition
1,3-Dimethylxanthine in which the hydrogen at position 8 is substituted by chlorine.
Chemical Information
- Molecular Formula
- C7H7ClN4O2
- Molecular Mass
- 214.60900
- Charge
- 0
- SMILES
- Cn1c2nc(Cl)[nH]c2c(=O)n(C)c1=O
- InChI
- InChI=1S/C7H7ClN4O2/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h1-2H3,(H,9,10)
- InChIKey
- RYIGNEOBDRVTHA-UHFFFAOYSA-N
Alternative Names
- 1,3-dimethyl-8-chloroxanthine
- 8-chloro-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
- 8-chloro-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
Drug Classification
-
organochlorine compoundView Class →
CHEBI:36683
-
purinesView Class →
CHEBI:26401
-
t255737
-
t256033
Important Medical Information
⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.
- Always consult with a healthcare professional before starting, stopping, or modifying any medication.
- Side effects may vary and this list may not be comprehensive.
- Drug interactions may occur with other medications.
Additional Identifiers
- oboInOwl#hasDbXref
- Reaxys:203068
- core#notation
- CHEBI:59771
Additional References
🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.
Additional Attributes
- oboInOwl#hasOBONamespace
- chebi_ontology
- oboInOwl#hasDbXref
- Reaxys:203068
- oboInOwl#id
- CHEBI:59771
- core#notation
- CHEBI:59771
- RO_0000087
- http://purl.obolibrary.org/obo/CHEBI_35337
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- chebi#is_conjugate_acid_of
- http://purl.obolibrary.org/obo/CHEBI_59778
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class
- chebi#is_conjugate_base_of
- http://purl.obolibrary.org/obo/CHEBI_59778
- owl#annotatedSource
- t255746
- owl#someValuesFrom
- t255470