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Chemical structure of Picropodophyllone

GC61185

Picropodophyllone

Also known as (5aR,8aS,9R)-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-[2]benzofuro[5,6-f][1,3]benzodioxole-5,8-dione

Picropodophyllone, an aryltetralin lignan, is isolated from leaves of Podophyllum hexandrum, and has antifungal activities

ChemicalCAS477-48-5MW412.39FormulaC22H20O8
CAS number
477-48-5
Molecular weight
412.39
Formula
C22H20O8
Solubility
DMSO ： 100 mg/mL (242·49 mM; Need ultrasonic)
InChIKey
ISCQYPPCSYRZOT-MJXNMMHHSA-N
Catalogue number
GC61185
Brand
GLPBIO
Computed properties PubChem CID 3083574 · XLogP 2.5 · TPSA 89.5 Ų · H-bond donors 0
XLogP
2.5
TPSA
89.5 Ų
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
30

SMILES COC1=CC(=CC(=C1OC)OC)[C@H]2[C@H]3[C@H](COC3=O)C(=O)C4=CC5=C(C=C24)OCO5

Computed descriptors from PubChem (CID 3083574), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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