[Des-Arg9]-BRADYKININ

Base Information

• Chemical Name: [Des-Arg9]-BRADYKININ
• CAS No.: 16875-11-9
• Molecular Formula: C₄₄H₆₁N₁₁O₁₀
• Molecular Weight: 904.036
• UNII: 58QE2VVE3Q
• Nikkaji Number: J246.187K
• ChEMBL ID: CHEMBL1890370
• Mol file: 16875-11-9.mol

Synonyms:9-de-Arg-bradykinin;9-des-arg-BK;bradykinin, des-Arg(9)-;bradykinin, des-Arg(9)-, diacetate salt;bradykinin, des-Arg(9)-, monoacetate salt;bradykinin, des-arginine(9)-;des-Arg(9)-bradykinin

Chemical Property of [Des-Arg9]-BRADYKININ

Chemical Property:

• Refractive Index: 1.684
• PKA: 3.34±0.10(Predicted)
• PSA: 317.58000
• Density: 1.47 g/cm³
• LogP: 0.95140
• Storage Temp.: −20°C
• XLogP3: -3.3
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 21
• Exact Mass: 903.46028719
• Heavy Atom Count: 65
• Complexity: 1720

Purity/Quality:

98%min ^*data from raw suppliers

Bradykinin Fragment 2-9 ≥97% (HPLC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: 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)O
• Isomeric SMILES: 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)O

Technology Process of [Des-Arg9]-BRADYKININ

There total 1 articles about [Des-Arg9]-BRADYKININ which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

bradykinin (58-82-2) → bradykinin fragment 2-9 (14033-55-7,14033-57-9,14033-59-1,14033-60-4,14109-49-0,16875-11-9)

Guidance literature:

With pig kidney aminopeptidase P; at 37 ℃; Enzyme kinetics;

DOI:10.1016/0006-2952(96)00180-3

Reference yield:

bradykinin fragment 2-9 (14033-55-7,14033-57-9,14033-59-1,14033-60-4,14109-49-0,16875-11-9) + Pentafluorophenylsulfanylcarbonylmethyl-tris-(2,4,6-trimethoxy-phenyl)-phosphonium; bromide → C73H95N11O20P(1+)

Guidance literature:

With dmap; In water; acetonitrile; for 0.25h; Ambient temperature;

DOI:10.1021/ac9608578

Reference yield:

methanol (67-56-1) + bradykinin fragment 2-9 (14033-55-7,14033-57-9,14033-59-1,14033-60-4,14109-49-0,16875-11-9) → C45H63N11O10

Guidance literature:

With sulfuric acid; for 24h; Ambient temperature;

DOI:10.1021/ja9609157

upstream raw materials:

bradykinin

Downstream raw materials:

C₆₀H₇₉N₁₃O₁₄S

Refernces