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ONO 4817

CAT: 0013-GTR19201614-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19201614-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
ONO-4817 is a broad-spectrum matrix metalloproteinase (MMP) inhibitor used in atherosclerosis research. It has been shown to suppress neointimal hyperplasia and plaque progression in hyperlipidemic rabbit models, supporting its application in cardiovascular disease studies involving both in vivo and in vitro experimental systems.
CAS Number
223472-31-9
Field of Research
Protein Biochemistry
Smiles
CCOCOC[C@H] (C[C@H] (C) C (=O) NO) NC (=O) c1ccc (Oc2ccccc2) cc1
Molecular Formula
C22H28N2O6
Molecular Weight
416.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ono-4817
CAS Number223472-31-9
PubChem CID9888141
IUPAC NameN-[(2S,4S)-1-(ethoxymethoxy)-5-(hydroxyamino)-4-methyl-5-oxopentan-2-yl]-4-phenoxybenzamide
Molecular FormulaC22H28N2O6
Molecular Weight416.5
XLogP2.6
Topological Polar Surface Area106
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Heavy Atom Count30
Formal Charge0
Complexity504
SMILES
CCOCOC[C@H](C[C@H](C)C(=O)NO)NC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2
InChI
InChI=1S/C22H28N2O6/c1-3-28-15-29-14-18(13-16(2)21(25)24-27)23-22(26)17-9-11-20(12-10-17)30-19-7-5-4-6-8-19/h4-12,16,18,27H,3,13-15H2,1-2H3,(H,23,26)(H,24,25)/t16-,18-/m0/s1
InChIKey
HDWWQELUBWGQGA-WMZOPIPTSA-N
Chemical Structure
2D Structure
2D structure of Ono-4817
CAS: 223472-31-9
CID: 9888141
Formula: C22H28N2O6
MW: 416.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight416.5
XLogP32.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Exact Mass416.19473662
Monoisotopic Mass416.19473662
Topological Polar Surface Area106 Ų
Heavy Atom Count30
Formal Charge0
Complexity504
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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