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Chicanine

CAT: 1410-M31613-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Chicanine has anti-inflammatory activity in macrophages by down-regulating LPS-induced inflammatory cytokines in IκBα±/MAPK/ERK signaling pathways.
CAS Number
78919-28-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
342.39
Molecular Formula
C20H22O5
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

4-((2R,3S,4R,5R)-5-(1,3-Benzodioxol-5-yl)tetrahydro-3,4-dimethyl-2-furanyl)-2-methoxyphenol

Chicanin has been reported in Schisandra glaucescens, Virola surinamensis, and other organisms with data available.

CAS Number78919-28-5
PubChem CID11078392
IUPAC Name4-[(2R,3S,4R,5R)-5-(1,3-benzodioxol-5-yl)-3,4-dimethyloxolan-2-yl]-2-methoxyphenol
Molecular FormulaC20H22O5
Molecular Weight342.4
XLogP3.9
Topological Polar Surface Area57.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity457
SMILES
C[C@@H]1[C@@H]([C@@H](O[C@H]1C2=CC3=C(C=C2)OCO3)C4=CC(=C(C=C4)O)OC)C
InChI
InChI=1S/C20H22O5/c1-11-12(2)20(14-5-7-16-18(9-14)24-10-23-16)25-19(11)13-4-6-15(21)17(8-13)22-3/h4-9,11-12,19-21H,10H2,1-3H3/t11-,12+,19+,20+/m0/s1
InChIKey
JPDORDSJPIKURD-OCBHBYCGSA-N
Chemical Structure
2D Structure
2D structure of 4-((2R,3S,4R,5R)-5-(1,3-Benzodioxol-5-yl)tetrahydro-3,4-dimethyl-2-furanyl)-2-methoxyphenol
CAS: 78919-28-5
CID: 11078392
Formula: C20H22O5
MW: 342.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight342.4
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass342.14672380
Monoisotopic Mass342.14672380
Topological Polar Surface Area57.2 Ų
Heavy Atom Count25
Formal Charge0
Complexity457
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TN1485Chicanine

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