The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

nitisinone
Synonyms

2-{[2-nitro-4-(trifluoromethyl)phenyl]carbonyl}cyclohexane-1,3-dione

C14H10F3NO5

ID

http://purl.obolibrary.org/obo/dinto_DB00348

ATCCode

A16AX04

binds

http://purl.obolibrary.org/obo/dinto_0373

CASRN

104206-65-7

DBBrand

orfadin

Definition

Nitisinone is a synthetic reversible inhibitor of 4-hydroxyphenylpyruvate dioxygenase. It is used in the treatment of hereditary tyrosinemia type 1. It is sold under the brand name Orfadin. [Wikipedia]

has pharmacological target

http://purl.obolibrary.org/obo/dinto_0373

InChI

InChI=1S/C14H10F3NO5/c15-14(16,17)7-4-5-8(9(6-7)18(22)23)13(21)12-10(19)2-1-3-11(12)20/h4-6,12H,1-3H2

InChIKey

InChIKey=OUBCNLGXQFSTLU-UHFFFAOYSA-N

inhibits

http://purl.obolibrary.org/obo/dinto_0373

label

nitisinone

prefixIRI

obo2:dinto_DB00348

prefLabel

nitisinone

SMILES

[O-][N+](=O)C1=C(C=CC(=C1)C(F)(F)F)C(=O)C1C(=O)CCCC1=O

Synonym

2-{[2-nitro-4-(trifluoromethyl)phenyl]carbonyl}cyclohexane-1,3-dione

C14H10F3NO5

xref

PharmGKB:PA164777037

Wikipedia:http://en.wikipedia.org/wiki/Nitisinone

Drugs.com:http://www.drugs.com/cdi/nitisinone.html

National Drug Code Directory:66621-1002-6

ChEBI:50378

ChemSpider:103195

PubChem Substance:46507380

RxList:http://www.rxlist.com/cgi/generic/orfadin.htm

PubChem Compound:115355

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

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