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Flavonoids

Platanoside

悬铃木苷

PHY-NP-17936 · Natural product research catalog

Catalog numberPHY-NP-17936
CAS number133740-25-7
Molecular formulaC39H32O14
Molecular weight724.671 g/mol
Chemical classFlavonoids
Main reported sourceCoriandrum sativum
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Platanoside

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Product information

Platanoside is listed in the Flavonoids 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,4R,5S,6S)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-5-hydroxy-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-6-methyloxan-4-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
SMILESC[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)OC(=O)/C=C/C5=CC=C(C=C5)O)OC(=O)/C=C/C6=CC=C(C=C6)O)O
InChIKeyHKZIBACORRUGAC-FIFPDCARSA-N
Subclass / scaffoldFlavonols
PubChem CID6451113

Computed properties

Exact mass (Da)724.1792Predicted LogP4.7229
Predicted TPSA (Ų)222.65H-bond donors6
H-bond acceptors14Rotatable bonds9

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

View additional properties & classification
Ring count6
Aromatic rings5
Fraction Csp³0.154
Synthetic accessibility score4.5
QED score0.089
Lipinski rule violations3
NPClassifier pathwayShikimates and Phenylpropanoids
NPClassifier superclassFlavonoids
NPClassifier classFlavonols
Parent SMILESC[C@@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H]1O
Parent formulaC39H32O14
Parent molecular weight724.671
Specified stereocenters5
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceCoriandrum sativum
Reported source familiesApiaceae; Platanaceae

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

View occurrence records & references
LOTUS / Wikidata speciesCoriandrum sativum[1]; Foeniculum vulgare[1]; Plantanus orientalis[1]; Platanus occidentalis[1]
All reported source familiesApiaceae[2]; Platanaceae[2]
LOTUS species records4
LOTUS reference records4
COCONUT occurrence recordsBuxus sempervirens; Coriandrum Sativum; Coriandrum sativum; Foeniculum vulgare; Mallotus philippensis; Plantanus orientalis; Platanus occidentalis
COCONUT organism records7
COCONUT identifierCNP0157765.3

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.