Camellianin B

Base Information

• Chemical Name: Camellianin B
• CAS No.: 109232-76-0
• Molecular Formula: C27H30 O14
• Molecular Weight: 578.52
• DSSTox Substance ID: DTXSID00148850
• Nikkaji Number: J2.159.077K
• Wikidata: Q83014502
• Metabolomics Workbench ID: 143864
• Mol file: 109232-76-0.mol

Synonyms:camellianin B

Chemical Property of Camellianin B

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 937.4°Cat760mmHg
• Flash Point: 312.4°C
• PSA: 228.97000
• Density: 1.69g/cm³
• LogP: -1.09830
• XLogP3: -1.3
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 6
• Exact Mass: 578.16355563
• Heavy Atom Count: 41
• Complexity: 939

Purity/Quality:

≥98% （HPLC） ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3=CC(=CC4=C3C(=O)C=C(O4)C5=CC=C(C=C5)O)O)CO)O)O)O
• Isomeric SMILES: C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)OC3=CC(=CC4=C3C(=O)C=C(O4)C5=CC=C(C=C5)O)O)CO)O)O)O