Phenylpropanoids

Ptelatoside b

PHY-NP-14667 · Natural product research catalog

Catalog number	PHY-NP-14667
CAS number	90852-99-6
Molecular formula	C₂₀H₂₈O₁₀
Molecular weight	428.434 g/mol
Chemical class	Phenylpropanoids
Main reported source	Pteridium aquilinum
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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50 mg	Request quote	To be confirmed	Confirm in quotation
100 mg	Request quote	To be confirmed	Confirm in quotation

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Ptelatoside b is listed in the Phenylpropanoids 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.

IUPAC name	(2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S,6R)-2-(4-ethenylphenoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
SMILES	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC=C(C=C3)C=C)CO)O)O)O)O)O
InChIKey	DIBOBJSTTKLQQV-QLDOSHOCSA-N
Subclass / scaffold	Cinnamic acids and derivatives
PubChem CID	130179

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

View additional properties & classification

Ring count	3
Aromatic rings	1
Fraction Csp³	0.6
Synthetic accessibility score	4.3
QED score	0.31
Lipinski rule violations	1
NPClassifier pathway	Shikimates and Phenylpropanoids
NPClassifier superclass	Phenylpropanoids (C6-C3)
NPClassifier class	Cinnamic acids and derivatives
Parent SMILES	C=Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1
Parent formula	C₂₀H₂₈O₁₀
Parent molecular weight	428.434
Specified stereocenters	10
Unspecified stereocenters	0

Main reported source	Pteridium aquilinum
Reported source families	Dennstaedtiaceae

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

View occurrence records & references

LOTUS / Wikidata species	Pteridium aquilinum[2]
All reported source families	Dennstaedtiaceae[1]
LOTUS species records	1
LOTUS reference records	2
COCONUT occurrence records	Artemisia lactiflora; Attalea excelsa; Catalpa ovata; Citrus hassaku; Coutarea latifolia; Crepidiastrum sonchifolium; Dipsacus asper; Duguetia calycina; Epirrhoe sperryi; Eriostemon spicatus; Garcinia pyrifera; Greenwayodendron oliveri; Hymenothrix wislizenii; Jacaranda chelonia; Ophryosporus floribundus; Payena lucida; Phalaris canariensis; Plumbagella micrantha; Pteridium aquilinum; Rivina humilis; Samadera indica; Streptomyces yokosukanensis; Tanacetum parthenifolium
COCONUT organism records	23
COCONUT identifier	CNP0266016.2

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

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

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