beta-Casomorphin 11

Base Information

• Chemical Name: beta-Casomorphin 11
• CAS No.: 101554-61-4
• Molecular Formula: C59H84 N12 O15
• Molecular Weight: 1201.36966
• DSSTox Substance ID: DTXSID50143996
• Wikidata: Q83008074
• Mol file: 101554-61-4.mol

Synonyms:beta-casomorphin 11;Tyr-Pro-Phe-Pro-Gly-Pro-Ile-Pro-Asn-Ser-Leu;tyrosyl-prolyl-phenylalanyl-prolyl-glycyl-prolyl-isoleucyl-prolyl-asparaginyl-seryl-leucine

Chemical Property of beta-Casomorphin 11

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1568.9°Cat760mmHg
• Flash Point: 902.6°C
• Density: 1.338g/cm³
• XLogP3: -1.8
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 28
• Exact Mass: 1200.61791002
• Heavy Atom Count: 86
• Complexity: 2440

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCC(C)C(C(=O)N1CCCC1C(=O)NC(CC(=O)N)C(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)O)NC(=O)C2CCCN2C(=O)CNC(=O)C3CCCN3C(=O)C(CC4=CC=CC=C4)NC(=O)C5CCCN5C(=O)C(CC6=CC=C(C=C6)O)N
• Isomeric SMILES: CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@H](CC4=CC=CC=C4)NC(=O)[C@@H]5CCCN5C(=O)[C@H](CC6=CC=C(C=C6)O)N

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