Aselacin C

Base Information

• Chemical Name: Aselacin C
• CAS No.: 156223-08-4
• Molecular Formula: C46H66 N8 O11
• Molecular Weight: 907.06
• Nikkaji Number: J588.479I
• Wikidata: Q77373757
• Metabolomics Workbench ID: 113574
• Mol file: 156223-08-4.mol

Synonyms:aselacin C

Chemical Property of Aselacin C

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1353.7°C at 760 mmHg
• Flash Point: 772.5°C
• PSA: 319.01000
• Density: 1.27g/cm³
• LogP: 5.40160
• XLogP3: 3
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 23
• Exact Mass: 906.48510495
• Heavy Atom Count: 65
• Complexity: 1670

Purity/Quality:

95%+ ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC=CC=CC(=O)CCCCCCCC(=O)NC(CCC(=O)N)C(=O)NC1C(OC(=O)CNC(=O)C(NC(=O)C(NC(=O)CCNC1=O)CC2=CNC3=CC=CC=C32)CO)C
• Isomeric SMILES: CCCCC/C=C/C=C/C(=O)CCCCCCCC(=O)N[C@H](CCC(=O)N)C(=O)N[C@H]1[C@H](OC(=O)CNC(=O)[C@H](NC(=O)[C@H](NC(=O)CCNC1=O)CC2=CNC3=CC=CC=C32)CO)C