Eupacunoxin

Base Information

• Chemical Name: Eupacunoxin
• CAS No.: 33853-88-2
• Molecular Formula: C22H28O8
• Molecular Weight: 0
• ChEMBL ID: CHEMBL484877
• Nikkaji Number: J18.795J
• Wikidata: Q27106553
• Mol file: 33853-88-2.mol

Synonyms:EUPACUNOXIN;CHEBI:4925;33853-88-2;CHEMBL484877;C09429;[(3aS,4R,5Z,7S,9S,10Z,11aR)-9-acetyloxy-7-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (2R,3R)-2,3-dimethyloxirane-2-carboxylate;Q27106553

Chemical Property of Eupacunoxin

Chemical Property:

• Vapor Pressure: 6.12E-15mmHg at 25°C
• Boiling Point: 561.4°C at 760 mmHg
• Flash Point: 190.1°C
• PSA: 111.66000
• Density: 1.26g/cm³
• LogP: 3.03450
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 420.17841785
• Heavy Atom Count: 30
• Complexity: 840

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(O1)(C)C(=O)OC2C=C(C(CC(C(=CC3C2C(=C)C(=O)O3)C)OC(=O)C)O)C
• Isomeric SMILES: C[C@@H]1[C@](O1)(C)C(=O)O[C@@H]2/C=C(\[C@H](C[C@@H](/C(=C\[C@@H]3[C@@H]2C(=C)C(=O)O3)/C)OC(=O)C)O)/C