De-amino-tyr-cholecystokinin octapeptide

Base Information

• Chemical Name: De-amino-tyr-cholecystokinin octapeptide
• CAS No.: 79672-08-5
• Molecular Formula: C58H69 I N10 O18 S3
• Molecular Weight: 0
• Mol file: 79672-08-5.mol

Synonyms:cholecystokinin octapeptide, des-NH2-Tyr;cholecystokinin octapeptide, desaminotyrosine-;DAT CCK-8;de-amino-Tyr-cholecystokinin octapeptide

Chemical Property of De-amino-tyr-cholecystokinin octapeptide

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 14
• Hydrogen Bond Acceptor Count: 20
• Rotatable Bond Count: 37
• Exact Mass: 1416.29982
• Heavy Atom Count: 90
• Complexity: 2560

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CSCCC(C(=O)NCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)NC(CC(=O)O)C(=O)NC(CC3=CC=CC=C3)C(=O)N)NC(=O)C(CC4=CC=C(C=C4)OS(=O)(=O)O)NC(=O)C(CC(=O)O)NC(=O)CCC5=CC(=C(C=C5)O)I
• Isomeric SMILES: CSCC[C@@H](C(=O)NCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N)NC(=O)[C@H](CC4=CC=C(C=C4)OS(=O)(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)CCC5=CC(=C(C=C5)O)I

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