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> Main
CHEBI:109540 - 3,4-dichloroisocoumarin
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ChEBI Name
3,4-dichloroisocoumarin
ChEBI ID
CHEBI:109540
Definition
A member of the class of isocoumarins that is isocoumarin substituted by chloro groups at positions 3 and 4. It is a serine protease inhibitor.
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This entity has been manually annotated by the ChEBI Team.
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Molfile
Formula
C9H4Cl2O2
Net Charge
0
Average Mass
215.030
Monoisotopic Mass
213.95883
InChI
InChI=1S/C9H4Cl2O2/c10-7-5-3-1-2-4-6(5)9(12)13-8(7)11/h1-4H
InChIKey
SUGXUUGGLDCZKB-UHFFFAOYSA-N
SMILES
ClC1=C(Cl)C2=C(C=CC=C2)C(=O)O1
Roles Classification
Biological Role
(s):
serine protease inhibitor
Any protease inhibitor that restricts the action of a serine protease.
Application
(s):
geroprotector
Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
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-1
H
-isochromen-1-one
Synonyms
Sources
3,4-DCI
ChEBI
3,4-dichloro-1
H
-2-benzopyran-1-one
IUPAC
3,4-dichloro-2-benzopyran-1-one
ChEBI
3,4-dichloroisochromen-1-one
PDBeChem
Manual Xrefs
Databases
1550
ChemSpider
DB04459
DrugBank
DIC
PDBeChem
LSM-20945
LINCS
View more database links
Registry Number
Type
Source
51050-59-0
CAS Registry Number
ChemIDplus
Citations
Types
Sources
1510927
PubMed citation
Europe PMC
1560024
PubMed citation
Europe PMC
22102236
PubMed citation
Europe PMC
22130671
PubMed citation
Europe PMC
22994701
PubMed citation
Europe PMC
2384149
PubMed citation
Europe PMC
24134630
PubMed citation
Europe PMC
31159170
PubMed citation
Europe PMC
33045272
PubMed citation
Europe PMC
34073808
PubMed citation
Europe PMC
3893537
PubMed citation
Europe PMC
7539490
PubMed citation
Europe PMC
7717987
PubMed citation
Europe PMC
9148956
PubMed citation
Europe PMC
9374874
PubMed citation
Europe PMC
9757085
PubMed citation
Europe PMC
9790170
PubMed citation
Europe PMC
Last Modified
20 September 2021