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Episappanol

CAT: 0013-GTR19183718-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19183718-02Size:50 mg
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Description
Episappanol is a bioactive small molecule with demonstrated anti-inflammatory properties, effectively suppressing the production of pro-inflammatory cytokines IL-6 and TNF-α. It serves as a valuable research tool for studying inflammatory pathways in both cellular and animal models of disease.
CAS Number
111254-18-3
Field of Research
Cell Biology, Immunology & Inflammation
Smiles
C ([C@]1 (O) [C@H] (O) C=2C (OC1) =CC (O) =CC2) C3=CC (O) =C (O) C=C3
Molecular Formula
C16H16O6
Molecular Weight
304.29
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Episappanol

Episappanol has been reported in Biancaea decapetala with data available.

CAS Number111254-18-3
PubChem CID13846650
IUPAC Name(3R,4R)-3-[(3,4-dihydroxyphenyl)methyl]-2,4-dihydrochromene-3,4,7-triol
Molecular FormulaC16H16O6
Molecular Weight304.29
XLogP0.9
Topological Polar Surface Area110
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity391
SMILES
C1[C@@]([C@@H](C2=C(O1)C=C(C=C2)O)O)(CC3=CC(=C(C=C3)O)O)O
InChI
InChI=1S/C16H16O6/c17-10-2-3-11-14(6-10)22-8-16(21,15(11)20)7-9-1-4-12(18)13(19)5-9/h1-6,15,17-21H,7-8H2/t15-,16-/m1/s1
InChIKey
MPGFEHZDABUJFR-HZPDHXFCSA-N
Chemical Structure
2D Structure
2D structure of Episappanol
CAS: 111254-18-3
CID: 13846650
Formula: C16H16O6
MW: 304.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight304.29
XLogP30.9
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass304.09468823
Monoisotopic Mass304.09468823
Topological Polar Surface Area110 Ų
Heavy Atom Count22
Formal Charge0
Complexity391
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
BA3559-5Episappanol

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