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Tremetone

CAT: 0013-GTR19198580-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198580-02Size:100 mg
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Description
Tremetone is a bioactive small molecule with significant anti-inflammatory and antioxidant properties. It is used in research to study oxidative stress and inflammation pathways in both cellular (in vitro) and animal (in vivo) experimental models.
CAS Number
4976-25-4
Smiles
C (C) (=C) [C@H]1CC=2C (O1) =CC=C (C (C) =O) C2
Molecular Formula
C13H14O2
Molecular Weight
202.25
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tremetone

Tremetone is a member of benzofurans.

CAS Number4976-25-4
PubChem CID78673
IUPAC Name1-[(2R)-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl]ethanone
Molecular FormulaC13H14O2
Molecular Weight202.25
XLogP2.9
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity282
SMILES
CC(=C)[C@H]1CC2=C(O1)C=CC(=C2)C(=O)C
InChI
InChI=1S/C13H14O2/c1-8(2)13-7-11-6-10(9(3)14)4-5-12(11)15-13/h4-6,13H,1,7H2,2-3H3/t13-/m1/s1
InChIKey
UVYUUQGGBNKRFU-CYBMUJFWSA-N
Chemical Structure
2D Structure
2D structure of Tremetone
CAS: 4976-25-4
CID: 78673
Formula: C13H14O2
MW: 202.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight202.25
XLogP32.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass202.099379685
Monoisotopic Mass202.099379685
Topological Polar Surface Area26.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity282
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T26290-01Tremetone
HY-121818(-) -Tremetone

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