Rustmicin

Base Information

• Chemical Name: Rustmicin
• CAS No.: 100227-57-4
• Molecular Formula: C21H32 O6
• Molecular Weight: 0
• Wikidata: Q105309472
• Metabolomics Workbench ID: 97912
• Mol file: 100227-57-4.mol

Synonyms:galbonolide;galbonolide A;rustmicin

Chemical Property of Rustmicin

Chemical Property:

• Vapor Pressure: 6.03E-16mmHg at 25°C
• Boiling Point: 581.5°Cat760mmHg
• Flash Point: 198.1°C
• PSA: 93.06000
• Density: 1.12g/cm³
• LogP: 2.69950
• XLogP3: 3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 380.21988874
• Heavy Atom Count: 27
• Complexity: 633

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1C(=CC(=C)CC(C=C(CC(C(=O)C(C(=O)O1)C)(CO)O)OC)C)C
• Isomeric SMILES: CC[C@H]1/C(=C/C(=C)C[C@@H](/C=C(/CC(C(=O)[C@H](C(=O)O1)C)(CO)O)\OC)C)/C