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OPB-3206

CAT: 0013-GTR19257795-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19257795-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
OPB-3206 is a selective inhibitor of matrix metalloproteinases (MMPs) . It inhibits stromelysin, collagenase, gelatinase A (MMP-2), and gelatinase B (MMP-9) with IC50 values of 7x10^-7 M, 5x10^-6 M, 5x10^-7 M, and 2x10^-6 M, respectively. OPB-3206 reversibly binds to the zinc-binding site of MMPs, blocking the activation of MMP-9 and reducing the degradation of the extracellular matrix, thereby inhibiting tumor lung metastasis. OPB-3206 shows potential for research in osteosarcoma lung metastasis.
CAS Number
166245-54-1
Field of Research
Protein Biochemistry, Stem Cell & Developmental Biology
Smiles
O (C) N1C=2C (C[C@H] (NC ([C@@H] (CC (NO) =O) CC (C) C) =O) C1=O) =CC=CC2
Molecular Formula
C18H25N3O5
Molecular Weight
363.41
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Opb-3206

structure in first source

CAS Number166245-54-1
PubChem CID9799104
IUPAC Name(2R)-N'-hydroxy-N-[(3S)-1-methoxy-2-oxo-3,4-dihydroquinolin-3-yl]-2-(2-methylpropyl)butanediamide
Molecular FormulaC18H25N3O5
Molecular Weight363.4
XLogP1.2
Topological Polar Surface Area108
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count26
Formal Charge0
Complexity525
SMILES
CC(C)C[C@H](CC(=O)NO)C(=O)N[C@H]1CC2=CC=CC=C2N(C1=O)OC
InChI
InChI=1S/C18H25N3O5/c1-11(2)8-13(10-16(22)20-25)17(23)19-14-9-12-6-4-5-7-15(12)21(26-3)18(14)24/h4-7,11,13-14,25H,8-10H2,1-3H3,(H,19,23)(H,20,22)/t13-,14+/m1/s1
InChIKey
OIVAPLYJZKBFMV-KGLIPLIRSA-N
Chemical Structure
2D Structure
2D structure of Opb-3206
CAS: 166245-54-1
CID: 9799104
Formula: C18H25N3O5
MW: 363.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight363.4
XLogP31.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass363.17942091
Monoisotopic Mass363.17942091
Topological Polar Surface Area108 Ų
Heavy Atom Count26
Formal Charge0
Complexity525
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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