tolcapone
CHEBI:CHEBI_63630
Definition
Benzophenone substituted on one of the phenyl rings at C-3 and C-4 by hydroxy groups and at C-5 by a nitro group, and on the other phenyl ring by a methyl group at C-4. It is an inhibitor of catechol O-methyltransferase.
Chemical Information
- Molecular Formula
- C14H11NO5
- Molecular Mass
- 273.24080
- Charge
- 0
- SMILES
- Cc1ccc(cc1)C(=O)c1cc(O)c(O)c(c1)[N+]([O-])=O
- InChI
- InChI=1S/C14H11NO5/c1-8-2-4-9(5-3-8)13(17)10-6-11(15(19)20)14(18)12(16)7-10/h2-7,16,18H,1H3
- InChIKey
- MIQPIUSUKVNLNT-UHFFFAOYSA-N
Alternative Names
- (3,4-dihydroxy-5-nitrophenyl)(4-methylphenyl)methanone
- 3,4-dihydroxy-4'-methyl-5-nitrobenzophenone
- 3,4-Dihydroxy-4'-methyl-5-nitrobenzophenone
- 3,4-dihydroxy-5-nitro-4'-methylbenzophenone
- 4'-methyl-3,4-dihydroxy-5-nitrobenzophenone
- tolcapone
Drug Classification
-
catecholsView Class →
CHEBI:33566
-
benzophenonesView Class →
CHEBI:22726
-
2-nitrophenolsView Class →
CHEBI:86421
-
t262248
-
t262332
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
- DRON_00010000
- 72937
- oboInOwl#hasDbXref
- Wikipedia:Tolcapone
- core#notation
- CHEBI:63630
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
- DRON_00010000
- 72937
- oboInOwl#id
- CHEBI:63630
- oboInOwl#hasAlternativeId
- CHEBI:9617
- oboInOwl#hasDbXref
- Wikipedia:Tolcapone
- generic_name
- TOLCAPONE
- product_type
- BULK INGREDIENT
- marketing_category
- BULK INGREDIENT FOR HUMAN PRESCRIPTION COMPOUNDING
- listing_expiration_date
- 20241231
- route
- ORAL
- dosage_form
- POWDER
- marketing_start_date
- 20040727
- labeler_name
- Ingenus Pharmaceuticals, LLC
- package_marketing_start_date
- 20040727
- product_ndc
- 0187-0938
- spl_id
- b5c3a96c-28c4-40b3-8b44-e977c4ca2a9c
- brand_name
- Tasmar
- brand_name_base
- Tasmar
- package_ndc
- 0187-0938-01
- package_description
- 90 TABLET, FILM COATED in 1 BOTTLE (0187-0938-01)
- manufacturer_name
- Ingenus Pharmaceuticals, LLC
- application_number
- NDA020697
- RO_0000087
- http://purl.obolibrary.org/obo/CHEBI_48406
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- core#notation
- CHEBI:63630
- rxcui
- 153655
- active_ingredient_strength
- 25 kg/25kg
- nui
- N0000175757
- pharm_class_epc
- Catechol-O-Methyltransferase Inhibitor [EPC]
- pharm_class
- Catechol O-Methyltransferase Inhibitors [MoA]
- pharm_class_moa
- Catechol O-Methyltransferase Inhibitors [MoA]
- active_ingredient_name
- TOLCAPONE
- unii
- CIF6334OLY
- spl_set_id
- a0e47a9d-78e7-4523-983a-aa259f221736
- upc
- 0301870938012
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class
- rdf-schema#domain
- https://w3id.org/def/predibionto#has_side_effect30727
- owl#annotatedSource
- t262945
- owl#someValuesFrom
- t719496