Furanojaponin

Base Information

• Chemical Name: Furanojaponin
• CAS No.: 34335-98-3
• Molecular Formula: C20H28O3
• Molecular Weight: 316.43452
• DSSTox Substance ID: DTXSID101103791
• Nikkaji Number: J17.567F
• Wikidata: Q104976427
• Mol file: 34335-98-3.mol

Synonyms:Furanojaponin;34335-98-3;CHEBI:191639;DTXSID101103791;[(4aR,5S,7R,8aR)-3,4a,5-trimethyl-5,6,7,8,8a,9-hexahydro-4H-benzo[][1]benzouran-7-yl] (Z)-2-methylbut-2-enoate;2-Butenoic acid, 2-methyl-, (4aR,5S,7R,8aR)-4,4a,5,6,7,8,8a,9-octahydro-3,4a,5-trimethylnaphtho[2,3-b]furan-7-yl ester, (2Z)-

Chemical Property of Furanojaponin

Chemical Property:

• Boiling Point: 110 - 130 °C (0.0005 mmHg)
• PSA: 39.44000
• LogP: 4.61700
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 316.20384475
• Heavy Atom Count: 23
• Complexity: 497

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=C(C)C(=O)OC1CC(C2(CC3=C(CC2C1)OC=C3C)C)C
• Isomeric SMILES: C/C=C(/C)\C(=O)O[C@@H]1C[C@@H]([C@]2(CC3=C(C[C@H]2C1)OC=C3C)C)C