Hericenone C

Base Information

• Chemical Name: Hericenone C
• CAS No.: 137592-03-1
• Molecular Formula: C₃₅H₅₄O₆
• Molecular Weight: 570.81
• DSSTox Substance ID: DTXSID401112686
• Metabolomics Workbench ID: 48442
• Nikkaji Number: J1.004.783H,J2.920.523J
• Mol file: 137592-03-1.mol

Synonyms:hericenone C

Chemical Property of Hericenone C

Chemical Property:

• XLogP3: 11.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 24
• Exact Mass: 570.39203944
• Heavy Atom Count: 41
• Complexity: 797

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCC(=O)OCC1=CC(=C(C(=C1C=O)O)CC=C(C)CC(=O)C=C(C)C)OC
• Isomeric SMILES: CCCCCCCCCCCCCCCC(=O)OCC1=CC(=C(C(=C1C=O)O)C/C=C(\C)/CC(=O)C=C(C)C)OC

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