(2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-((1R,3R)-3-((E)-3-hydroxy-2-methylprop-1-enyl)-2,2-dimethylcyclopropanecarbonyl)oxyoxane-2-carboxylic acid

Base Information

• Chemical Name: (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-((1R,3R)-3-((E)-3-hydroxy-2-methylprop-1-enyl)-2,2-dimethylcyclopropanecarbonyl)oxyoxane-2-carboxylic acid
• CAS No.: 93132-72-0
• Molecular Formula: C16H24O9
• Molecular Weight: 360.3564
• Mol file: 93132-72-0.mol

Synonyms:(2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-((1R,3R)-3-((E)-3-hydroxy-2-methylprop-1-enyl)-2,2-dimethylcyclopropanecarbonyl)oxyoxane-2-carboxylic acid;93132-72-0

Chemical Property of (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-((1R,3R)-3-((E)-3-hydroxy-2-methylprop-1-enyl)-2,2-dimethylcyclopropanecarbonyl)oxyoxane-2-carboxylic acid

Chemical Property:

• Vapor Pressure: 6.27E-15mmHg at 25°C
• Boiling Point: 561.1°C at 760 mmHg
• Flash Point: 202°C
• Density: 1.46g/cm³
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 6
• Exact Mass: 360.14203234
• Heavy Atom Count: 25
• Complexity: 570

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CC1C(C1(C)C)C(=O)OC2C(C(C(C(O2)C(=O)O)O)O)O)CO
• Isomeric SMILES: C/C(=C\[C@@H]1[C@H](C1(C)C)C(=O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)/CO