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Tyrosinase-IN-27

CAT: 0013-GTR19235113-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19235113-01Size:10 mg
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Description
Tyrosinase-IN-27 (6f) is a potent tyrosinase inhibitor (IC50 = 0.88 μM) that acts by binding to the enzyme, increasing its local hydrophobicity and altering its secondary structure to reduce α-helix content. This mechanism effectively suppresses enzymatic activity, making it a useful research tool for studying pigmentation and for in vitro applications like preventing food browning, as demonstrated with lotus root slices.
CAS Number
2966803-96-1
Field of Research
Protein Biochemistry
Smiles
C (CC) C=1C=2C (=CC (OCC3=CC (=O) C (O) =CO3) =CC2) OC (=O) C1
Molecular Formula
C18H16O6
Molecular Weight
328.32
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tyrosinase-IN-27
CAS Number2966803-96-1
PubChem CID169087624
IUPAC Name7-[(5-hydroxy-4-oxopyran-2-yl)methoxy]-4-propylchromen-2-one
Molecular FormulaC18H16O6
Molecular Weight328.3
XLogP2.3
Topological Polar Surface Area82.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity615
SMILES
CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC(=O)C(=CO3)O
InChI
InChI=1S/C18H16O6/c1-2-3-11-6-18(21)24-17-8-12(4-5-14(11)17)22-9-13-7-15(19)16(20)10-23-13/h4-8,10,20H,2-3,9H2,1H3
InChIKey
VYKBWBTUJCWENV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tyrosinase-IN-27
CAS: 2966803-96-1
CID: 169087624
Formula: C18H16O6
MW: 328.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight328.3
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass328.09468823
Monoisotopic Mass328.09468823
Topological Polar Surface Area82.1 Ų
Heavy Atom Count24
Formal Charge0
Complexity615
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

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