prosolanapyrone I

Base Information

• Chemical Name: prosolanapyrone I
• CAS No.: 154584-30-2
• Molecular Formula: C₁₈H₂₄O₃
• Molecular Weight: 288.387
• DSSTox Substance ID: DTXSID801155874
• Wikidata: Q27117417
• Metabolomics Workbench ID: 55814
• Mol file: 154584-30-2.mol

Synonyms:prosolanapyrone I;4-methoxy-3-methyl-6-[(1E,7E,9E)-undeca-1,7,9-trien-1-yl]-2H-pyran-2-one;CHEBI:38236;DTXSID801155874;4-methoxy-3-methyl-6-[(1E,7E,9E)-undeca-1,7,9-trienyl]pyran-2-one;Q27117417;4-Methoxy-3-methyl-6-(1E,7E,9E)-1,7,9-undecatrien-1-yl-2H-pyran-2-one;154584-30-2

Chemical Property of prosolanapyrone I

Chemical Property:

• PSA: 39.44000
• LogP: 4.66270
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 288.17254462
• Heavy Atom Count: 21
• Complexity: 491

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=CC=CCCCCC=CC1=CC(=C(C(=O)O1)C)OC
• Isomeric SMILES: C/C=C/C=C/CCCC/C=C/C1=CC(=C(C(=O)O1)C)OC

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