prosolanapyrone II

Base Information

• Chemical Name: prosolanapyrone II
• CAS No.: 154584-31-3
• Molecular Formula: C₁₈H₂₄O₄
• Molecular Weight: 304.386
• DSSTox Substance ID: DTXSID701137463
• Metabolomics Workbench ID: 55815
• Nikkaji Number: J974.250F
• Wikidata: Q27117418
• Mol file: 154584-31-3.mol

Synonyms:prosolanapyrone II;3-(hydroxymethyl)-4-methoxy-6-[(1E,7E,9E)-undeca-1,7,9-trienyl]pyran-2-one;3-(hydroxymethyl)-4-methoxy-6-[(1E,7E,9E)-undeca-1,7,9-trien-1-yl]-2H-pyran-2-one;CHEBI:38238;DTXSID701137463;154584-31-3;C19933;Q27117418;3-(Hydroxymethyl)-4-methoxy-6-(1E,7E,9E)-1,7,9-undecatrien-1-yl-2H-pyran-2-one

Chemical Property of prosolanapyrone II

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 304.16745924
• Heavy Atom Count: 22
• Complexity: 507

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

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

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