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CHEBI:231333 - givinostat hydrochloride
| Formula | C24H27N3O4.HCl |
| Net Charge | 0 |
| Average Mass | 457.958 |
| Monoisotopic Mass | 457.17683 |
| SMILES | CCN(CC)Cc1ccc2cc(COC(=O)Nc3ccc(C(=O)NO)cc3)ccc2c1.Cl |
| InChI | InChI=1S/C24H27N3O4.ClH/c1-3-27(4-2)15-17-5-7-21-14-18(6-8-20(21)13-17)16-31-24(29)25-22-11-9-19(10-12-22)23(28)26-30;/h5-14,30H,3-4,15-16H2,1-2H3,(H,25,29)(H,26,28);1H |
| InChIKey | QKSGNWJOQMSBEP-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: | antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. anti-inflammatory agent Any compound that has anti-inflammatory effects. angiogenesis inhibitor An agent and endogenous substances that antagonize or inhibit the development of new blood vessels. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| givinostat hydrochloride (CHEBI:231333) has part givinostat(1+) (CHEBI:231334) |
| givinostat hydrochloride (CHEBI:231333) has role angiogenesis inhibitor (CHEBI:48422) |
| givinostat hydrochloride (CHEBI:231333) has role anti-inflammatory agent (CHEBI:67079) |
| givinostat hydrochloride (CHEBI:231333) has role antineoplastic agent (CHEBI:35610) |
| givinostat hydrochloride (CHEBI:231333) has role apoptosis inducer (CHEBI:68495) |
| givinostat hydrochloride (CHEBI:231333) has role EC 3.5.1.98 (histone deacetylase) inhibitor (CHEBI:61115) |
| givinostat hydrochloride (CHEBI:231333) is a hydrochloride (CHEBI:36807) |
| Incoming Relation(s) |
| givinostat hydrochloride monohydrate (CHEBI:231335) has part givinostat hydrochloride (CHEBI:231333) |
| IUPAC Names |
|---|
| {6-[(diethylamino)methyl]naphthalen-2-yl}methyl [4-(hydroxycarbamoyl)phenyl]carbamate—hydrogen chloride |
| {6-[(diethylamino)methyl]naphthalen-2-yl}methyl [4-(hydroxycarbamoyl)phenyl]carbamate hydrochloride |
| Synonyms | Source |
|---|---|
| givinostat HCl | ChEBI |
| givinostat monohydrochloride | ChEBI |
| ITF-2357 hydrochloride | ChEBI |
| ITF 2357 hydrochloride | ChEBI |
| ITF2357 hydrochloride | ChEBI |
| Registry Numbers | Sources |
|---|---|
| CAS:199657-29-9 | ChEBI |