Products for Research Use Only

(-) -Catechin

CAT: 0013-GTR19204407-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19204407-07Size:100 mg
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Description
(-) -Catechin ((-) -Cianidanol) is a stereoisomer of catechin that acts as a cyclooxygenase-1 (COX-1) inhibitor, exhibiting an IC50 of 1.4 μM. This compound is a useful research tool for studying inflammation and related pathways in both in vitro biochemical assays and cellular models.
CAS Number
18829-70-4
Product Name Alternative
(-) -Catechuic acid, (-) -Cianidanol, Catechin, Catechuic acid, Cianidanol, COX-1
Field of Research
Immunology & Inflammation, Neuroscience
Purity
98.06% (May vary between batches)
Solubility
DMSO:125 mg/mL (430.63 mM)
Smiles
O[C@@H]1Cc2c (O) cc (O) cc2O[C@H]1c1ccc (O) c (O) c1
Molecular Formula
C15H14O6
Molecular Weight
290.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(-)-Catechol

(-)-catechin is the ()-enantiomer of catechin. It has a role as a metabolite. It is an enantiomer of a (+)-catechin.

CAS Number18829-70-4
PubChem CID73160
IUPAC Name(2S,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
Molecular FormulaC15H14O6
Molecular Weight290.27
XLogP0.4
Topological Polar Surface Area110
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity364
SMILES
C1[C@H]([C@@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
InChI
InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m1/s1
InChIKey
PFTAWBLQPZVEMU-HIFRSBDPSA-N
Chemical Structure
2D Structure
2D structure of (-)-Catechol
CAS: 18829-70-4
CID: 73160
Formula: C15H14O6
MW: 290.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight290.27
XLogP30.4
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass290.07903816
Monoisotopic Mass290.07903816
Topological Polar Surface Area110 Ų
Heavy Atom Count21
Formal Charge0
Complexity364
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