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CHEBI:94741 - N-hydroxy-7-(naphthalen-2-ylthio)heptanamide

Default Structure
ChEBI IDCHEBI:94741
ChEBI NameN-hydroxy-7-(naphthalen-2-ylthio)heptanamide
Stars
ASCII NameN-hydroxy-7-(naphthalen-2-ylthio)heptanamide
DefinitionA member of the class of naphthalenes that is naphthalene substituted by a [7-(hydroxyamino)-7-oxoheptyl]sulfanediyl group at position 2. It is a histone deacetylase inhibitor that exhibits antineoplastic activity.
Last Modified3 February 2025
DownloadsMolfile
FormulaC17H21NO2S
Net Charge0
Average Mass303.427
Monoisotopic Mass303.12930
SMILESO=C(CCCCCCSc1ccc2ccccc2c1)NO
InChIInChI=1S/C17H21NO2S/c19-17(18-20)9-3-1-2-6-12-21-16-11-10-14-7-4-5-8-15(14)13-16/h4-5,7-8,10-11,13,20H,1-3,6,9,12H2,(H,18,19)
InChIKeyKPNNXHVGOKRBEF-UHFFFAOYSA-N
Roles Classification
Biological Roles:
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
EC 3.5.1.98 (histone deacetylase) inhibitor  An EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor that interferes with the function of histone deacetylase (EC 3.5.1.98).
Applications:
antifibrotic agent  Any agent which acts to reduce fibrosis.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
angiogenesis inhibitor  An agent and endogenous substances that antagonize or inhibit the development of new blood vessels.
ChEBI Ontology
Outgoing Relation(s)
N-hydroxy-7-(naphthalen-2-ylthio)heptanamide (CHEBI:94741) has role angiogenesis inhibitor (CHEBI:48422)
N-hydroxy-7-(naphthalen-2-ylthio)heptanamide (CHEBI:94741) has role antifibrotic agent (CHEBI:233423)
N-hydroxy-7-(naphthalen-2-ylthio)heptanamide (CHEBI:94741) has role antineoplastic agent (CHEBI:35610)
N-hydroxy-7-(naphthalen-2-ylthio)heptanamide (CHEBI:94741) has role apoptosis inducer (CHEBI:68495)
N-hydroxy-7-(naphthalen-2-ylthio)heptanamide (CHEBI:94741) has role EC 3.5.1.98 (histone deacetylase) inhibitor (CHEBI:61115)
N-hydroxy-7-(naphthalen-2-ylthio)heptanamide (CHEBI:94741) is a aryl sulfide (CHEBI:35683)
N-hydroxy-7-(naphthalen-2-ylthio)heptanamide (CHEBI:94741) is a hydroxamic acid (CHEBI:24650)
N-hydroxy-7-(naphthalen-2-ylthio)heptanamide (CHEBI:94741) is a naphthalenes (CHEBI:25477)
IUPAC Name 
N-hydroxy-7-(naphthalen-2-ylsulfanyl)heptanamide
Synonyms  Source
N-hydroxy-7-(2-naphthalenylthio)-heptanamideChEBI
N-hydroxy-7-(2-naphthalenylthio)heptanamideChEBI
N-hydroxy-7-(2-naphthylthio)heptanamideChEBI
N-hydroxy-7-(2-naphthylthio)heptanomideChEBI
N-hydroxy-7-naphthalen-2-ylsulfanylheptanamideChEBI
histone deacetylase inhibitor VIChEBI
Manual XrefsDatabases
LSM-5837LINCS
Registry NumbersSources
CAS:926908-04-5ChEBI
Citations