HuagongsheHuagongshe Chemistry Print Report · For research reference only
Cgp 42112A
CGP 42112 · CGP-42112A · CGP 42112 TFA · CGP42112A, CGP42112 · CGP-42112 (CGP42112 · ANGIOTENSIN II ANTAGONIST · ANGIOTENSIN II RECEPTOR LIGAND · NIC-TYR-LYS(Z-ARG)-HIS-PRO-ILE
Identifiers & Physical Properties
| CAS No. | 127060-75-7 |
|---|---|
| Molecular formula | C52H69N13O11 |
| Average molar mass | 1,052.204 g/mol |
| Monoisotopic mass | 1,051.52395003 g/mol |
| SMILES | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCNC(=O)[C@H](CCCN=C(N)N)NC(=O)OCc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cccnc1)C(=O)O |
| InChIKey | UXGNARZDONUMMK-LRMQDCNJSA-N |
| PubChem CID | 123794 |
| ChEMBL | CHEMBL1885579 |
| ChEBI | CHEBI:147302 |
| DTXSID | DTXSID90155396 |
Chemical & Physical Properties
| Density | 1.39±0.1 g/cm3(Predicted) |
|---|---|
| Storage conditions | -20°C |
| Solubility | DMSO:350.0(Max Conc. mg/mL)332.64(Max Conc. mM)Soluble to 1 mg/ml in water |
| pKa (acidity coefficient) | 3.72±0.22(Predicted) |
| Physical state | solid |
| Color | white |
| Biological source | synthetic |
| BRN | 8184948 |
| InChIKey | UXGNARZDONUMMK-LRMQDCNJSA-N |
| SMILES | CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H](CCCCNC(=O)[C@H](CCCNC(N)=N)NC(=O)OCc3ccccc3)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)c5cccnc5)C(O)=O |
| FDA UNII | 9Q3V7W3XDD |
| UNSPSC Code | 12352200 |
| NACRES | NA.77 |
| Personal protective equipment (PPE) | Eyeshields, Gloves, type N95 (US) |
| Safety statements (S) | 22-24/25 |
| Water hazard class (WGK) | 3 |
| F | 10 |
| Storage class | 11 - Combustible Solids |
Safety & Regulations
| F | 10 |
|---|---|
| Personal protective equipment (PPE) | Eyeshields, Gloves, type N95 (US) |
| Water hazard class (WGK) | 3 |
| Safety statements (S) | 22-24/25 |
| Storage class | 11 - Combustible Solids |
Applications & Uses
Uses
CGP-42112A has been used:in the isolation of RNA from fibroblast-like synoviocytes from rheumatoid arthritis patients (RA-FLS)to study its effects on the ERK2 phosphorylation in the cardiomyoblast cell lineas a stimulator of angiotensin II type 2 (AT2) receptor to study its effects on human regional hemodynamic responses mediated by AT2 receptors