Sirtinol
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Sirtinol
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CAS No:
410536-97-9
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Formula:
C26H22N2O2
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Chemical Name:
Sirtinol
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Synonyms:
Benzamide,2-[[(2-hydroxy-1-naphthalenyl)methylene]amino]-N-(1-phenylethyl)-;2-[[(2-Hydroxy-1-naphthalenyl)methylene]amino]-N-(1-phenylethyl)benzamide;Sirtinol;S 2804
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CAS No:
Description
Sirtinol is a sirtuin inhibitor, with IC50s of 48 μM, 57.7 μM and 131 μM for ySir2, hSIRT2 and hSIRT2, respectively.
Sirtinol is a benzamide obtained by formal condensation of the carboxy group of 2-{[(2-hydroxy-1-naphthyl)methylene]amino}benzoic acid with the amino group of 1-phenylethylamine. It has a role as an anti-inflammatory agent, an EC 3.5.1.98 (histone deacetylase) inhibitor and a Sir2 inhibitor. It is a member of benzamides, an aldimine and a member of naphthols. It derives from an anthranilic acid.
Characteristics
61.69000
6.17790
1.2±0.1 g/cm3
119-120 °C @ Solvent: Acetonitrile
650°C at 760 mmHg
352.5±30.1 °C
1.623
soluble in water, DMSO and methanol
−20°C
Sirtinol Use and Manufacturing
Sirtinol is a known inhibitor of the NAD+-Dependent Protein Desuccinylase and Demalonylase Sirt5 and exhibits anticancer properties.
Computed Properties
Molecular Weight:394.5
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:394.168127949
Monoisotopic Mass:394.168127949
Topological Polar Surface Area:61.7
Heavy Atom Count:30
Complexity:586
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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