Callitachykinin I

Base Information

• Chemical Name: Callitachykinin I
• CAS No.: 158275-30-0
• Molecular Formula: C46H69 N13 O11
• Molecular Weight: 980.12
• Mol file: 158275-30-0.mol

Synonyms:callitachykinin I

Chemical Property of Callitachykinin I

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 420.90000
• Density: 1.42g/cm³
• LogP: 5.20680
• XLogP3: -1.5
• Hydrogen Bond Donor Count: 13
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 26
• Exact Mass: 979.52395007
• Heavy Atom Count: 70
• Complexity: 1840

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C(=O)NC(CCCN=C(N)N)C(=O)N)NC(=O)CNC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(C)NC(=O)C(C(C)O)NC(=O)C3CCCN3C(=O)C(C)N
• Isomeric SMILES: C[C@H]([C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)NC(CCCN=C(N)N)C(=O)N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](C)N)O