3-Deazaneplanocin A hydrochloride - CAS 120964-45-6

3-Deazaneplanocin A hydrochloride (CAT: I000783) is indeed known for its inhibition of the cellular enhancer of zeste homolog 2 (EZH2) protein, which is a component of the polycomb repressive complex 2 (PRC2) involved in gene silencing through histone methylation. By inhibiting EZH2, DZNep disrupts the methylation of histones and can lead to the reactivation of tumor suppressor genes and inhibition of cancer cell growth. This epigenetic modulation makes DZNep a promising anticancer agent with potential therapeutic applications in various types of cancers.

Catalog Number: I000783

CAS Number: 120964-45-6

PubChem Substance ID:355040519

Molecular Formula: C₁₂H₁₄N₄O₃. HCl

Molecular Weight:298.73

Purity: ≥95%

* For research use only. Not for human or veterinary use.

Synonym

Synonyms(1S,2R,5R)-5-(4-aminoimidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol;hydrochloride

Property

Molecular Formula: C₁₂H₁₄N₄O₃. HCl
Molecular Weight298.73
Target:iPSC
SolubilityDMSO: 52 mg/mL, H2O: 52 mg/mL
Purity≥95%
Storage3 years -20C powder
MDLMFCD18782644
IC500.08-0.24 μM (NSCLC cell) [2]

Computed Descriptor

IUPAC Name(1S,2R,5R)-5-(4-aminoimidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol;hydrochloride
InChIInChI=1S/C12H14N4O3.ClH/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19;/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14);1H
InChIKeyUNSKMHKAFPRFTI-UHFFFAOYSA-N
SMILESC1=CN=C(C2=C1N(C=N2)C3C=C(C(C3O)O)CO)N.Cl