Physalolactone C

Base Information

• Chemical Name: Physalolactone C
• CAS No.: 92594-02-0
• Molecular Formula: C28H37ClO7
• Molecular Weight: 521.0422
• Wikidata: Q104945297
• Metabolomics Workbench ID: 75641
• Mol file: 92594-02-0.mol

Synonyms:Physalolactone C;( )-Physalolactone C;6-(1-{8-chloro-6,7,14-trihydroxy-2,15-dimethyl-3-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-4,11-dien-14-yl}-1-hydroxyethyl)-3,4-dimethyl-5,6-dihydro-2H-pyran-2-one;CHEBI:187847;LMST01160014;2-[1-(6-chloro-4,5,17-trihydroxy-10,13-dimethyl-1-oxo-4,6,7,8,9,11,12,16-octahydrocyclopenta[a]phenanthren-17-yl)-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one

Chemical Property of Physalolactone C

Chemical Property:

• Vapor Pressure: 4.4E-23mmHg at 25°C
• Boiling Point: 706.7°Cat760mmHg
• Flash Point: 381.2°C
• Density: 1.37g/cm³
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 520.2227812
• Heavy Atom Count: 36
• Complexity: 1130

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=O)OC(C1)C(C)(C2(CC=C3C2(CCC4C3CC(C5(C4(C(=O)C=CC5O)C)O)Cl)C)O)O)C