Description

SMER3 (CAS 67200-34-4) is a high-purity heterocyclic organic compound with the molecular formula C₁₁H₄N₄O₂ and IUPAC name 13-oxa-10,12,14,16-tetrazatetracyclo[7.7.0.0^2,7.0^11,15]hexadeca-1(16),2,4,6,9,11,14-heptaen-8-one. This specialized chemical is rigorously synthesized and purified to meet the stringent requirements of research and industrial applications. SMER3 is provided as a stable, lyophilized solid with ≥95% purity (HPLC), ensuring reproducibility in experimental results. Suitable for use in biochemical assays, medicinal chemistry, and drug discovery research, it is packaged under inert conditions to guarantee long-term stability. Each batch is accompanied by comprehensive analytical documentation, including ¹H NMR, HPLC, and mass spectrometry data.

Properties

• CAS Number: 67200-34-4
• Complexity: 350
• IUPAC Name: 13-oxa-10,12,14,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2,4,6,9,11,14-heptaen-8-one
• InChI: InChI=1S/C11H4N4O2/c16-9-6-4-2-1-3-5(6)7-8(9)13-11-10(12-7)14-17-15-11/h1-4H
• InChI Key: SFSSAKVWCKFRHE-UHFFFAOYSA-N
• Exact Mass: 224.03342538
• Molecular Formula: C11H4N4O2
• Molecular Weight: 224.17
• SMILES: C1=CC=C2C(=C1)C3=NC4=NON=C4N=C3C2=O
• Topological: 81.8
• Monoisotopic Mass: 224.03342538
• Synonyms: 67200-34-4, SMER3, DTXSID40340952, DTXCID90292033, SMER 3, 9H-Indeno[1,2-b][1,2,5]oxadiazolo[3,4-E]pyrazin-9-one, 9H-Indeno[1,2-e][1,2,5]oxadiazolo[3,4-b]pyrazin-9-one, 9H-Indeno-[1,2-e]-[1,2,5]-oxadiazolo-[3,4-b]-pyrazin-9-one, indeno[2,3-b]1,2,5-oxadiazolo[3,4-e]pyrazin-5-one, SMER-3, MFCD00451458, SMER3(SMER 3), Oprea1_175199, Oprea1_783821, SCHEMBL7984580, CHEMBL3589013, CHEBI:131171, SFSSAKVWCKFRHE-UHFFFAOYSA-N, BDBM188214, GLXC-06650, HMS1607O01, BCP14360, SCA20034, LSM-42773, SBB000632, STK120842, SMER3, >=98% (HPLC), AKOS000479457, AS-55891, BP-42851, HY-10949, ST000573, DB-073845, CS-0002970, Indeno[1,2-b]furazano[3,4-E]pyrazin-9-one, E98654, Indeno[1,2-b]furazano[3,4-E]pyrazin-9-one,, US9073941, 28, US9073941, 30, EN300-18558227, SR-01000388225, SR-01000388225-1, Q27224946, Z2739880762, 9H-Indeno[1,2-b][1,2,5]oxadiazolo[3,4-E]pyrazin-9-one #, 13-oxa-10,12,14,16-tetraazatetracyclo[7.7.0.0^{2,7}.0^{11,15}]hexadeca-1(16),2,4,6,9,11,14-heptaen-8-one, 13-oxa-10,12,14,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2,4,6,9,11,14-heptaen-8-one

Application

SMER3 is a biologically active compound primarily investigated for its potential as a modulator of ubiquitin-proteasome pathways in cancer research. It has shown promise in studies targeting protein degradation mechanisms and cell cycle regulation. Researchers utilize SMER3 in biochemical assays to explore novel therapeutic strategies for oncology applications. Its unique tetracyclic structure makes it valuable for structure-activity relationship studies in medicinal chemistry.

Safety and Hazards

GHS Hazard Statements

• H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

Precautionary Statements

• P264, P270, P301+P317, P330, and P501

Hazard Classes and Categories

• Acute Tox. 4 (100%)

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