Malonofungin

Base Information

• Chemical Name: Malonofungin
• CAS No.: 154032-80-1
• Molecular Formula: C23H39 N O9
• Molecular Weight: 473.56
• Wikidata: Q105236028
• Mol file: 154032-80-1.mol

Synonyms:5-acetoxy-2-amino-2-carboxy-3,4-dihydroxy-14-oxoicos-6-enoic acid;malonofungin

Chemical Property of Malonofungin

Chemical Property:

• Vapor Pressure: 6.61E-23mmHg at 25°C
• Boiling Point: 703.9°Cat760mmHg
• PKA: 0.69±0.50(Predicted)
• Flash Point: 379.5°C
• PSA: 170.46000
• Density: 1.192g/cm³
• LogP: 2.55200
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 21
• Exact Mass: 473.26248182
• Heavy Atom Count: 33
• Complexity: 621

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(=O)CCCCCCC=CC(C(C(NC(C(=O)O)C(=O)O)O)O)OC(=O)C
• Isomeric SMILES: CCCCCCC(=O)CCCCCC/C=C/[C@@H]([C@@H]([C@H](NC(C(=O)O)C(=O)O)O)O)OC(=O)C