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CHEBI:109540 - 3,4-dichloroisocoumarin

ChEBI IDCHEBI:109540
ChEBI Name3,4-dichloroisocoumarin
Stars
DefinitionA member of the class of isocoumarins that is isocoumarin substituted by chloro groups at positions 3 and 4. It is a serine protease inhibitor.
Last Modified20 September 2021
DownloadsMolfile
FormulaC9H4Cl2O2
Net Charge0
Average Mass215.035
Monoisotopic Mass213.95883
SMILESO=c1oc(Cl)c(Cl)c2ccccc12
InChIInChI=1S/C9H4Cl2O2/c10-7-5-3-1-2-4-6(5)9(12)13-8(7)11/h1-4H
InChIKeySUGXUUGGLDCZKB-UHFFFAOYSA-N
Roles Classification
Biological Role:
serine protease inhibitor  Any protease inhibitor that restricts the action of a serine protease.
Application:
geroprotector  Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
ChEBI Ontology
Outgoing Relation(s)
3,4-dichloroisocoumarin (CHEBI:109540) has role geroprotector (CHEBI:176497)
3,4-dichloroisocoumarin (CHEBI:109540) has role serine protease inhibitor (CHEBI:64926)
3,4-dichloroisocoumarin (CHEBI:109540) is a isocoumarins (CHEBI:38758)
3,4-dichloroisocoumarin (CHEBI:109540) is a organochlorine compound (CHEBI:36683)
IUPAC Name 
3,4-dichloro-1H-isochromen-1-one
Synonyms  Source
3,4-dichloro-1H-2-benzopyran-1-oneIUPAC
3,4-dichloro-2-benzopyran-1-oneChEBI
3,4-DCIChEBI
3,4-dichloroisochromen-1-onePDBeChem
Manual XrefsDatabases
LSM-20945LINCS
1550ChemSpider
DB04459DrugBank
DICPDBeChem
Registry NumbersSources
CAS:51050-59-0ChemIDplus
Citations