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Styrylpyrones

Goniopypyrone

PHY-NP-14882 · Natural product research catalog

Catalog numberPHY-NP-14882
CAS number129578-07-0
Molecular formulaC13H14O5
Molecular weight250.25 g/mol
Chemical classStyrylpyrones
Main reported sourceGoniothalamus cardiopetalus
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Goniopypyrone

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Product information

Goniopypyrone is listed in the Styrylpyrones section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC name(1R,5S,7S,8R)-8,9-dihydroxy-7-phenyl-2,6-dioxabicyclo[3.3.1]nonan-3-one
SMILESC1[C@H]2C([C@H]([C@@H]([C@@H](O2)C3=CC=CC=C3)O)OC1=O)O
InChIKeyXIHDWURQMYWEBZ-NFNQGEQYSA-N
Subclass / scaffoldKavalactones and derivatives
PubChem CID164274

Computed properties

Exact mass (Da)250.0841Predicted LogP0.1638
Predicted TPSA (Ų)75.99H-bond donors2
H-bond acceptors5Rotatable bonds1

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification
Ring count3
Aromatic rings1
Fraction Csp³0.462
Synthetic accessibility score4.46
QED score0.695
Lipinski rule violations0
NPClassifier pathwayShikimates and Phenylpropanoids
NPClassifier superclassStyrylpyrones
NPClassifier classKavalactones and derivatives
Parent SMILESO=C1C[C@@H]2O[C@@H](c3ccccc3)[C@@H](O)[C@H](O1)C2O
Parent formulaC13H14O5
Parent molecular weight250.25
Specified stereocenters4
Unspecified stereocenters1

Reported natural occurrence

Main reported sourceGoniothalamus cardiopetalus
Reported source familiesAnnonaceae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references
LOTUS / Wikidata speciesGoniothalamus cardiopetalus[1]; Goniothalamus griffithii[1]
All reported source familiesAnnonaceae[2]
LOTUS species records2
LOTUS reference records2
COCONUT occurrence recordsGoniothalamus cardiopetalus; Goniothalamus griffithii
COCONUT organism records2
COCONUT identifierCNP0113627.5

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

Request applicable documentation and handling information before ordering or use.