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Sphondin

CAT: 0013-GTR19157769-07Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19157769-07Size:50 mg
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Description
Sphondin has anticonvulsant anti-inflammatory and anti-proliferative activities it possessed an inhibitory effect on IL-1beta-induced increase in the level of COX-2 protein and PGE (2) release in A549 cells.
CAS Number
483-66-9
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 25 mg/mL (115.64 mM)
Smiles
COc1cc2ccc (=O) oc2c2ccoc12
Molecular Formula
C12H8O4?
Molecular Weight
216.19
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Sphondin

Sphondin is a furanocoumarin.

CAS Number483-66-9
PubChem CID108104
IUPAC Name6-methoxyfuro[2,3-h]chromen-2-one
Molecular FormulaC12H8O4
Molecular Weight216.19
XLogP2.2
Topological Polar Surface Area48.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count16
Formal Charge0
Complexity325
SMILES
COC1=C2C(=C3C(=C1)C=CC(=O)O3)C=CO2
InChI
InChI=1S/C12H8O4/c1-14-9-6-7-2-3-10(13)16-11(7)8-4-5-15-12(8)9/h2-6H,1H3
InChIKey
DLCJNIBLOSKIQW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sphondin
CAS: 483-66-9
CID: 108104
Formula: C12H8O4
MW: 216.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight216.19
XLogP32.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass216.04225873
Monoisotopic Mass216.04225873
Topological Polar Surface Area48.7 Ų
Heavy Atom Count16
Formal Charge0
Complexity325
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-N2429-01Sphondin

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