Diosbulbin C

Base Information

• Chemical Name: Diosbulbin C
• CAS No.: 20086-07-1
• Molecular Formula: C19H22O7
• Molecular Weight: 362.3738
• Metabolomics Workbench ID: 47498
• Wikidata: Q110186266
• Mol file: 20086-07-1.mol

Synonyms:Diosbulbin C;20086-07-1;(3R,5S,6R,8R,10R,11S,12S)-3-(Furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.01,5.06,11]pentadecane-10-carboxylic acid;3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.01,5.06,11]pentadecane-10-carboxylic acid;CHEBI:175644;AKOS040761631;3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.0^{1,5}.0^{6,11}]pentadecane-10-carboxylic acid;3-(uran-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.01,5.06,11]pentadecane-10-carboxylic acid

Chemical Property of Diosbulbin C

Chemical Property:

• Vapor Pressure: 1.55E-15mmHg at 25°C
• Melting Point: 247-250 °C
• Refractive Index: 1.62
• Boiling Point: 606 °C at 760 mmHg
• PKA: 4.36±0.70(Predicted)
• Flash Point: 320.3 °C
• PSA: 106.20000
• Density: 1.46g/cm³
• LogP: 1.90310
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 362.13655304
• Heavy Atom Count: 26
• Complexity: 650

Purity/Quality:

99%, ^*data from raw suppliers

DiosbulbinC 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CC(OC13CC(C4C2CC(CC4C(=O)O)O)OC3=O)C5=COC=C5