4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide (CHEBI:125562)

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ChEBI Name	4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide

ChEBI ID	CHEBI:125562

ChEBI ASCII Name	4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide

Definition	A benzamide resulting from the formal condensation of the carboxy group of 4-(dimethylamino)benzoic acid with the amino group of 7-amino-N-hydroxyheptanamide. It is a potent inhibitor of histone deacetylases and induces cell cycle arrest and apoptosis in several human cancer cell lines.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C16H25N3O3

Net Charge

Average Mass

307.389

Monoisotopic Mass

307.18959

InChI

InChI=1S/C16H25N3O3/c1-19(2)14-10-8-13(9-11-14)16(21)17-12-6-4-3-5-7-15(20)18-22/h8-11,22H,3-7,12H2,1-2H3,(H,17,21)(H,18,20)

InChIKey

MXWDSZWTBOCWBK-UHFFFAOYSA-N

SMILES

CN(C)C1=CC=C(C=C1)C(=O)NCCCCCCC(=O)NO

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	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).

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide (CHEBI:125562) has role antineoplastic agent (CHEBI:35610) 4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide (CHEBI:125562) has role apoptosis inducer (CHEBI:68495) 4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide (CHEBI:125562) has role EC 3.5.1.98 (histone deacetylase) inhibitor (CHEBI:61115) 4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide (CHEBI:125562) is a benzamides (CHEBI:22702) 4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide (CHEBI:125562) is a hydroxamic acid (CHEBI:24650) 4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide (CHEBI:125562) is a secondary carboxamide (CHEBI:140325) 4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide (CHEBI:125562) is a tertiary amino compound (CHEBI:50996)

IUPAC Name

4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide

Synonyms	Sources
4-dimethylamino-N-(6-hydroxycarbamoylhexyl)benzamide	ChEBI
D237	ChEBI
histone deacetylase inhibitor III	ChEBI
M-344	LINCS
M344	ChEBI
N-hydroxy-7-(4-dimethylaminobenzoyl)aminoheptanamide	ChEBI

Registry Number	Type	Source
8570090	Reaxys Registry Number	Reaxys

Last Modified

06 November 2018