Casokefamide

Base Information

• Chemical Name: Casokefamide
• CAS No.: 98815-38-4
• Molecular Formula: C33H40 N6 O7
• Molecular Weight: 632.7067
• UNII: B453T1E8MP
• DSSTox Substance ID: DTXSID30243827
• Nikkaji Number: J561.805C
• Wikipedia: Casokefamide
• Wikidata: Q5048995
• NCI Thesaurus Code: C77281
• ChEMBL ID: CHEMBL2106384
• Mol file: 98815-38-4.mol

Synonyms:beta casomorphin 4027;casokefamide;casomorphin analog 4027;Tyr-Ala-Phe-Ala-Tyr-NH2;tyrosyl-alanyl-phenylalanyl-alanyl-tyrosinamide

Chemical Property of Casokefamide

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1108.9 °C at 760 mmHg
• Flash Point: 624.4 °C
• PSA: 225.97000
• Density: 1.304 g/cm³
• LogP: 2.88150
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 15
• Exact Mass: 632.29584764
• Heavy Atom Count: 46
• Complexity: 1020

Purity/Quality:

HPLC>98% ^*data from raw suppliers

TYR-DALA-PHE-DALA-TYR-NH2 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)N)NC(=O)C(CC3=CC=C(C=C3)O)N
• Isomeric SMILES: C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N)NC(=O)[C@H](CC3=CC=C(C=C3)O)N