11,20-Epoxy-1,11,12-trihydroxy-15-(2-undecenoyl)oxypicras-3,13(21)-diene-2,16-dione

Base Information

• Chemical Name: 11,20-Epoxy-1,11,12-trihydroxy-15-(2-undecenoyl)oxypicras-3,13(21)-diene-2,16-dione
• CAS No.: 87790-39-4
• Molecular Formula: C31H42O9
• Molecular Weight: 558.6598
• Mol file: 87790-39-4.mol

Synonyms:11,20-epoxy-1,11,12-trihydroxy-15-(2-undecenoyl)oxypicras-3,13(21)-diene-2,16-dione;SUN 0237;SUN-0237;SUN0237

Chemical Property of 11,20-Epoxy-1,11,12-trihydroxy-15-(2-undecenoyl)oxypicras-3,13(21)-diene-2,16-dione

Chemical Property:

• Vapor Pressure: 6.59E-25mmHg at 25°C
• Boiling Point: 734.6°Cat760mmHg
• Flash Point: 235.1°C
• Density: 1.3g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 10
• Exact Mass: 558.28288291
• Heavy Atom Count: 40
• Complexity: 1140

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CC(=O)OC1C2C(=C)C(C3(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O
• Isomeric SMILES: CCCCCCCC/C=C/C(=O)O[C@@H]1[C@H]2C(=C)[C@H]([C@]3([C@H]4[C@@]2(CO3)[C@@H](C[C@@H]5[C@@]4([C@@H](C(=O)C=C5C)O)C)OC1=O)O)O