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NTU281

CAT: 0013-GTR19185413-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19185413-03Size:100 mg
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Description
NTU281 is a potent and selective transglutaminase 2 (TG2) inhibitor. It ameliorates key pathological features of diabetic nephropathy in rodent models, including proteinuria, serum creatinine elevation, glomerular fibrosis, and apoptosis, making it a valuable research tool for studying diabetes-induced glomerulosclerosis.
CAS Number
815619-12-6
Field of Research
Cell Biology, Protein Biochemistry
Smiles
[C@H] (CC1=CC=CC=C1) (C (N[C@@H] (CCC (C[S+] (C) C) =O) C (O) =O) =O) NC (OCC2=CC=CC=C2) =O
Molecular Formula
C25H31N2O6S
Molecular Weight
487.59
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

CID 11433028
CAS Number815619-12-6
PubChem CID11433028
IUPAC Name[(5S)-5-carboxy-2-oxo-5-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentyl]-dimethylsulfanium
Molecular FormulaC25H31N2O6S+
Molecular Weight487.6
XLogP3.1
Topological Polar Surface Area123
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count14
Heavy Atom Count34
Formal Charge1
Complexity674
SMILES
C[S+](C)CC(=O)CC[C@@H](C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C25H30N2O6S/c1-34(2)17-20(28)13-14-21(24(30)31)26-23(29)22(15-18-9-5-3-6-10-18)27-25(32)33-16-19-11-7-4-8-12-19/h3-12,21-22H,13-17H2,1-2H3,(H2-,26,27,29,30,31,32)/p+1/t21-,22-/m0/s1
InChIKey
MQKDBWQFOOQINN-VXKWHMMOSA-O
Chemical Structure
2D Structure
2D structure of CID 11433028
CAS: 815619-12-6
CID: 11433028
Formula: C25H31N2O6S+
MW: 487.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight487.6
XLogP33.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count14
Exact Mass487.19028289
Monoisotopic Mass487.19028289
Topological Polar Surface Area123 Ų
Heavy Atom Count34
Formal Charge1
Complexity674
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

Alternative Products

CatalogName
MBS5805921NTU281

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