Lignans

Picropodophyllin

苦鬼臼毒素

PHY-NP-05791 · Natural product research catalog

Catalog number	PHY-NP-05791
CAS number	17434-18-3
Molecular formula	C₂₂H₂₂O₈
Molecular weight	414.41 g/mol
Chemical class	Lignans
Main reported source	Juniperus sabina
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Picropodophyllin is listed in the Lignans 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	(5R,5aR,8aS,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one
SMILES	COC1=CC(=CC(=C1OC)OC)[C@H]2[C@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)O
InChIKey	YJGVMLPVUAXIQN-HAEOHBJNSA-N
Subclass / scaffold	Arylnaphthalene and aryltetralin lignans
PubChem CID	72435

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

View additional properties & classification

Ring count	5
Aromatic rings	2
Fraction Csp³	0.409
Synthetic accessibility score	3.75
QED score	0.763
Lipinski rule violations	0
NPClassifier pathway	Shikimates and Phenylpropanoids
NPClassifier superclass	Lignans
NPClassifier class	Arylnaphthalene and aryltetralin lignans
Parent SMILES	COc1cc([C@@H]2c3cc4c(cc3[C@H](O)[C@H]3COC(=O)[C@@H]23)OCO4)cc(OC)c1OC
Parent formula	C₂₂H₂₂O₈
Parent molecular weight	414.41
Specified stereocenters	4
Unspecified stereocenters	0

Main reported source	Juniperus sabina
Reported source families	Cupressaceae; Berberidaceae; Apiaceae

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

View occurrence records & references

LOTUS / Wikidata species	Juniperus sabina[2]; Juniperus thurifera[2]; Podophyllum hexandrum[2]; Anthriscus sylvestris[1]; Hernandia sonora[1]; Podophyllum peltatum[1]
All reported source families	Cupressaceae[3]; Berberidaceae[2]; Apiaceae[1]; Hernandiaceae[1]
Genus / family records	Juniperus[1]
LOTUS species records	6
LOTUS reference records	10
COCONUT occurrence records	Achillea grandifolia; Actinobole uliginosum; Aglaia meridionalis; Allium ursinum; Ammi majus; Amycolatopsis lurida; Anacystis cyanea; Anthriscus sylvestris; Arcangelisia gusanlung; Artemisia schmidtiana; Babylonia japonica; Brickellia pendula; Callyspongia truncata; Carthamus lanatus; Chaetomium retardatum; Chalcas paniculata; Chamaemelum scariosum; Citrus tankan; Cladonia incrassata; Cladonia pseudodidyma; Cladosporium herbarum; Cleidion brevipetiolatum; Coleus carnosus; Copaifera paupera; Cortinarius basirubescens; Crotalaria lechnaultii; Croton nitens; Dimorphotheca sinuata; Diphylleia grayi; Diphylleia sinensis
COCONUT organism records	89
COCONUT identifier	CNP0213414.5

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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