Rhinacanthin C

Base Information

• Chemical Name: Rhinacanthin C
• CAS No.: 159278-74-7
• Molecular Formula: C25H30 O5
• Molecular Weight: 410.5
• UNII: T5Z47BVF6Z
• DSSTox Substance ID: DTXSID801104671
• Nikkaji Number: J678.303A,J2.478.962D
• Wikidata: Q27134846
• Metabolomics Workbench ID: 64505
• ChEMBL ID: CHEMBL462962
• Mol file: 159278-74-7.mol

Synonyms:3-(1-hydroxy-3,4-dioxo-3,4-dihydro-2-naphthalenyl)-2,2-dimethylpropyl (2E,6E)-2,6-dimethyl-2,6-octadienoate;rhinacanthin C;rhinacanthin-C

Chemical Property of Rhinacanthin C

Chemical Property:

• Boiling Point: 562.5±50.0 °C(Predicted)
• Density: 1.146±0.06 g/cm3(Predicted)
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 410.20932405
• Heavy Atom Count: 30
• Complexity: 781

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC=C(C)CCC=C(C)C(=O)OCC(C)(C)CC1=C(C2=CC=CC=C2C(=O)C1=O)O
• Isomeric SMILES: C/C=C(\C)/CC/C=C(\C)/C(=O)OCC(C)(C)CC1=C(C2=CC=CC=C2C(=O)C1=O)O