Bradykinin triacetate

Base Information

• Chemical Name: Bradykinin triacetate
• CAS No.: 5979-11-3
• Molecular Formula: C50H73N15O11.3C2H4O2
• Molecular Weight: 1240.38
• European Community (EC) Number: 227-781-2
• UNII: 6XS68K58Z5
• Wikidata: Q27265681
• Mol file: 5979-11-3.mol

Synonyms:Arg Pro Pro Gly Phe Ser Pro Phe Arg;Arg-Pro-Pro-Gly-Phe-Ser-Pro-Phe-Arg;Bradykinin;Bradykinin Acetate, (9-D-Arg)-Isomer;Bradykinin Diacetate;Bradykinin Hydrochloride;Bradykinin Triacetate;Bradykinin, (1-D-Arg)-Isomer;Bradykinin, (2-D-Pro)-Isomer;Bradykinin, (2-D-Pro-3-D-Pro-7-D-Pro)-Isomer;Bradykinin, (2-D-Pro-7-D-Pro)-Isomer;Bradykinin, (3-D-Pro)-Isomer;Bradykinin, (3-D-Pro-7-D-Pro)-Isomer;Bradykinin, (5-D-Phe)-Isomer;Bradykinin, (5-D-Phe-8-D-Phe)-Isomer;Bradykinin, (6-D-Ser)-Isomer;Bradykinin, (7-D-Pro)-Isomer;Bradykinin, (8-D-Phe)-Isomer;Bradykinin, (9-D-Arg)-Isomer

Chemical Property of Bradykinin triacetate

Chemical Property:

• Appearance/Colour: white powder
• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 150-160℃
• Boiling Point: 1618.8 °C at 760 mmHg
• Flash Point: 932.8 °C
• PSA: 525.68000
• LogP: 1.55400
• Storage Temp.: 2-8°C
• Solubility.: DMF: 50 mg/mL, clear, colorless
• Hydrogen Bond Donor Count: 15
• Hydrogen Bond Acceptor Count: 20
• Rotatable Bond Count: 27
• Exact Mass: 1239.62478630
• Heavy Atom Count: 88
• Complexity: 2110

Purity/Quality:

99% ^*data from raw suppliers

N-Formyl-Met-Leu-Phe ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(=O)O.CC(=O)O.CC(=O)O.C1CC(N(C1)C(=O)C2CCCN2C(=O)C(CCCN=C(N)N)N)C(=O)NCC(=O)NC(CC3=CC=CC=C3)C(=O)NC(CO)C(=O)N4CCCC4C(=O)NC(CC5=CC=CC=C5)C(=O)NC(CCCN=C(N)N)C(=O)O
• Isomeric SMILES: CC(=O)O.CC(=O)O.CC(=O)O.C1C[C@H](N(C1)C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)N)C(=O)NCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CO)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CC5=CC=CC=C5)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O
• Uses: N-Formyl-Met-Leu-Phe is an inducer of superoxide release and agonist for FPR1.