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CAS 5979-11-3

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Bradykinin, triacetate (salt)

Description:
Bradykinin, triacetate (salt) is a synthetic peptide derived from bradykinin, a naturally occurring peptide that plays a crucial role in various physiological processes, including vasodilation and inflammation. The triacetate form indicates that three acetyl groups are attached to the molecule, which can influence its solubility and stability. This compound is typically characterized by its ability to interact with specific receptors in the body, leading to effects such as increased vascular permeability and smooth muscle contraction. It is often used in research settings to study the kinin system and its implications in pain, cardiovascular function, and inflammatory responses. The CAS number 5979-11-3 uniquely identifies this substance in chemical databases, facilitating its recognition and study. As a salt, it may exhibit different physical properties compared to its free acid form, such as enhanced solubility in aqueous solutions. Overall, bradykinin triacetate serves as a valuable tool in pharmacological and biochemical research.
Formula:C56H85N15O17
InChI:InChI=1/C50H73N15O11.3C2H4O2/c51-32(16-7-21-56-49(52)53)45(72)65-25-11-20-39(65)47(74)64-24-9-18-37(64)43(70)58-28-40(67)59-34(26-30-12-3-1-4-13-30)41(68)62-36(29-66)46(73)63-23-10-19-38(63)44(71)61-35(27-31-14-5-2-6-15-31)42(69)60-33(48(75)76)17-8-22-57-50(54)55;3*1-2(3)4/h1-6,12-15,32-39,66H,7-11,16-29,51H2,(H,58,70)(H,59,67)(H,60,69)(H,61,71)(H,62,68)(H,75,76)(H4,52,53,56)(H4,54,55,57);3*1H3,(H,3,4)
SMILES:c1ccc(cc1)CC(C(=NC(CO)C(=O)N1CCCC1C(=NC(Cc1ccccc1)C(=NC(CCCNC(=N)N)C(=O)O)O)O)O)N=C(CN=C(C1CCCN1C(=O)C1CCCN1C(=O)C(CCCNC(=N)N)N)O)O.CC(=O)O.CC(=O)O.CC(=O)O
Synonyms:
  • Bradykinin triacetate
  • N~5~-(diaminomethylidene)ornithylprolylprolylglycylphenylalanylserylprolylphenylalanyl-N~5~-(diaminomethylidene)ornithine acetate (1:3)
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