Tyr-pro-gly-pro-phe-pro-ile

Base Information

• Chemical Name: Tyr-pro-gly-pro-phe-pro-ile
• CAS No.: 97453-39-9
• Molecular Formula: C41H55N7O9
• Molecular Weight: 789.9169
• DSSTox Substance ID: DTXSID50913914
• Wikidata: Q82884647
• Mol file: 97453-39-9.mol

Synonyms:beta-casomorphin I;Tyr-Pro-Gly-Pro-Phe-Pro-Ile;tyrosyl-prolyl-glycyl-prolyl-phenylalanyl-prolyl-isoleucine

Chemical Property of Tyr-pro-gly-pro-phe-pro-ile

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1170.5°Cat760mmHg
• Flash Point: 661.7°C
• PSA: 63.68000
• Density: 1.32g/cm³
• LogP: 1.44990
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 16
• Exact Mass: 789.40612636
• Heavy Atom Count: 57
• Complexity: 1450

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C(C(=O)O)NC(=O)C1CCCN1C(=O)C(CC2=CC=CC=C2)NC(=O)C3CCCN3C(=O)CNC(=O)C4CCCN4C(=O)C(CC5=CC=C(C=C5)O)N
• Isomeric SMILES: CC[C@H](C)[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]3CCCN3C(=O)CNC(=O)[C@@H]4CCCN4C(=O)[C@H](CC5=CC=C(C=C5)O)N