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CHEBI:233577 - ranirestat

ChEBI IDCHEBI:233577
ChEBI Nameranirestat
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SubmitterFlyBase
DownloadsMolfile
FormulaC17H11BrFN3O4
Net Charge0
Average Mass420.194
Monoisotopic Mass418.99170
SMILESO=C1c2cccn2[C@@]2(CC(O)=NC2=O)C(=O)N1Cc1ccc(Br)cc1F
InChIInChI=1S/C17H11BrFN3O4/c18-10-4-3-9(11(19)6-10)8-21-14(24)12-2-1-5-22(12)17(16(21)26)7-13(23)20-15(17)25/h1-6H,7-8H2,(H,20,23,25)/t17-/m1/s1
InChIKeyQCVNMNYRNIMDKV-QGZVFWFLSA-N
Wikipedia
Roles Classification
Biological Role:
EC 1.1.1.21 (aldehyde reductase) inhibitor  An EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD+ or NADP+ acceptor) inhibitor that interferes with the action of aldehyde reductase (EC 1.1.1.21).
ChEBI Ontology
Outgoing Relation(s)
ranirestat (CHEBI:233577) has role EC 1.1.1.21 (aldehyde reductase) inhibitor (CHEBI:48550)
ranirestat (CHEBI:233577) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(3R)-2'-[(4-bromo-2-fluorophenyl)methyl]spiro[pyrrolidine-3,4'-pyrrolo[1,2-a]pyrazine]-1',2,3',5-tetrone
Synonyms  Source
AS-3201SUBMITTER
SX-3030SUBMITTER
Manual XrefsDatabases
DB05327DrugBank
D06403KEGG DRUG
https://en.wikipedia.org/wiki/RanirestatWikipedia
Registry NumbersSources
CAS:147254-64-6SUBMITTER
Citations