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Stilbene glucosides

POLYDATIN

虎杖苷

PHY-NP-02320 · Natural product research catalog

Catalog numberPHY-NP-02320
CAS number27208-80-6
Molecular formulaC20H22O8
Molecular weight390.388 g/mol
Chemical classStilbene glucosides
Main reported sourceVitis vinifera
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of POLYDATIN

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Product information

POLYDATIN is listed in the Stilbene glucosides 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(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
SMILESOC[C@H]1O[C@@H](Oc2cc(O)cc(/C=C/c3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
InChIKeyHSTZMXCBWJGKHG-CUYWLFDKSA-N
Subclass / scaffoldMonomeric stilbenes
PubChem CID5281718

Computed properties

Exact mass (Da)390.1315Predicted LogP0.4469
Predicted TPSA (Ų)139.84H-bond donors6
H-bond acceptors8Rotatable bonds5

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

View additional properties & classification
Ring count3
Aromatic rings2
Fraction Csp³0.3
Synthetic accessibility score3.69
QED score0.405
Lipinski rule violations1
NPClassifier pathwayShikimates and Phenylpropanoids
NPClassifier superclassStilbenoids
NPClassifier classMonomeric stilbenes
Parent SMILESOC[C@H]1O[C@@H](Oc2cc(O)cc(/C=C/c3ccc(O)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
Parent formulaC20H22O8
Parent molecular weight390.388
Specified stereocenters5
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceVitis vinifera
Reported source familiesDipterocarpaceae; Polygonaceae; Fabaceae

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

View occurrence records & references
LOTUS / Wikidata speciesVitis vinifera[22]; Picea abies[3]; Cynomorium songaricum[2]; Eucalyptus rubida[2]; Humulus lupulus[2]; Lens culinaris[2]; Phyllolobium chinense[2]; Upuna borneensis[2]; Vateria indica[2]; Abies nephrolepis[1]; Calligonum leucocladum[1]; Cotylelobium lanceolatum[1]; Cyclocarya paliurus[1]; Erythrophleum lasianthum[1]; Fagopyrum megacarpum[1]
All reported source familiesDipterocarpaceae[9]; Polygonaceae[8]; Fabaceae[6]; Vitaceae[5]; Melanthiaceae[4]; Pinaceae[3]
Genus / family recordsLycopersicon[1]
LOTUS species records49
LOTUS reference records72
COCONUT occurrence recordsAbies nephrolepis; Abies sp.; Acacia adunca; Aconitum heterophylloides; Aconitum seravschanicum; Aconitum tasiromontanum; Adansonia grandidieri; Adiantum lunulatum; Alstonia spathulata; Amathia pinnata; Ampelopsis Brevipedunculata; Anacystis montana; Annona cornifolia; Aphyllocladus denticulatus; Arachis hypogaea; Artemisia assoana; Aster sedifolius; Asterospicularia laurae; Astragalus cibarius; Astragalus sempervirens; Bassia muricata; Bishovia boliviensis; Blastochloris viridis; Boehmeria nivea; Bulla striata; Calliandra confusa; Calligonum leucocladum; Calostephane divaricata; Caragana aurantiaca; Carica pennata
COCONUT organism records189
COCONUT identifierCNP0422611.1

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

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