Rubicordifolin

Base Information

• Chemical Name: Rubicordifolin
• CAS No.: 849699-55-4
• Molecular Formula: C33H28O9
• Molecular Weight: 568.57
• UNII: ZCR8BY5KW4
• DSSTox Substance ID: DTXSID601030377
• Nikkaji Number: J2.154.080C
• Wikidata: Q7376093
• Wikipedia: Rubicordifolin
• Mol file: 849699-55-4.mol

Synonyms:rubicordifolin

Chemical Property of Rubicordifolin

Chemical Property:

• PSA: 135.66000
• LogP: 6.02840
• XLogP3: 6.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 4
• Exact Mass: 568.17333247
• Heavy Atom Count: 42
• Complexity: 1080

Purity/Quality:

99% ^*data from raw suppliers

Rubicordifolin 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1(CC2C(OC(=O)C3=C(C4=CC=CC=C4C(=C23)O1)O)C(C)(C)O)C5=CC6=C(O5)C7=CC=CC=C7C(=C6C(=O)OC)O
• Isomeric SMILES: C[C@@]1(C[C@H]2[C@@H](OC(=O)C3=C(C4=CC=CC=C4C(=C23)O1)O)C(C)(C)O)C5=CC6=C(O5)C7=CC=CC=C7C(=C6C(=O)OC)O