Triornicin

Base Information

• Chemical Name: Triornicin
• CAS No.: 77165-75-4
• Molecular Formula: C31H50 N6 O12
• Molecular Weight: 698.76
• Nikkaji Number: J261.786B
• Mol file: 77165-75-4.mol

Synonyms:triornicin

Chemical Property of Triornicin

Chemical Property:

• PSA: 265.92000
• Density: 1.279g/cm³
• LogP: 1.08860
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 22
• Exact Mass: 698.34867105
• Heavy Atom Count: 49
• Complexity: 1240

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CC(=O)N(CCCC1C(=O)NC(C(=O)N1)CCCN(C(=O)C=C(C)CCOC(=O)C(CCCN(C(=O)C)O)NC(=O)C)O)O)CCO
• Isomeric SMILES: C/C(=C\C(=O)N(CCC[C@H]1C(=O)N[C@H](C(=O)N1)CCCN(C(=O)/C=C(\C)/CCOC(=O)[C@H](CCCN(C(=O)C)O)NC(=O)C)O)O)/CCO