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653592-04-2,MFCD30738019
Catalog No.:AA01EO2D

653592-04-2 | MT-DADMe-ImmA

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$53.00   $37.00
- +
5mg
≥98%
in stock  
$242.00   $169.00
- +
10mg
≥98%
in stock  
$430.00   $301.00
- +
25mg
≥98%
in stock  
$1,006.00   $704.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01EO2D
Chemical Name:
MT-DADMe-ImmA
CAS Number:
653592-04-2
Molecular Formula:
C13H19N5OS
Molecular Weight:
293.3879
MDL Number:
MFCD30738019
SMILES:
CSC[C@H]1CN(C[C@@H]1O)Cc1c[nH]c2c1ncnc2N
Properties
Computed Properties
 
Complexity:
334  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0  

Literature

Title: Transition state analogue inhibitors of human methylthioadenosine phosphorylase and bacterial methylthioadenosine/S-adenosylhomocysteine nucleosidase incorporating acyclic ribooxacarbenium ion mimics.

Journal: Bioorganic & medicinal chemistry 20120901

Title: Transition state analogs of 5'-methylthioadenosine nucleosidase disrupt quorum sensing.

Journal: Nature chemical biology 20090401

Title: Azetidine based transition state analogue inhibitors of N-ribosyl hydrolases and phosphorylases.

Journal: Journal of medicinal chemistry 20080227

Title: Structural rationale for the affinity of pico- and femtomolar transition state analogues of Escherichia coli 5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase.

Journal: The Journal of biological chemistry 20050506

Title: Evans GB, et al. Second generation transition state analogue inhibitors of human 5'-methylthioadenosine phosphorylase. J Med Chem. 2005 Jul 14;48(14):4679-89.

Title: Basu I, et al. A transition state analogue of 5'-methylthioadenosine phosphorylase induces apoptosis in head and neck cancers. J Biol Chem. 2007 Jul 20;282(29):21477-86.

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SDS
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Tags:653592-04-2 Molecular Formula|653592-04-2 MDL|653592-04-2 SMILES|653592-04-2 MT-DADMe-ImmA
Catalog No.: AA01EO2D
653592-04-2,MFCD30738019
653592-04-2 | MT-DADMe-ImmA
Pack Size： 1mg
Purity： ≥98%
in stock
$53.00 $37.00
Pack Size： 5mg
Purity： ≥98%
in stock
$242.00 $169.00
Pack Size： 10mg
Purity： ≥98%
in stock
$430.00 $301.00
Pack Size： 25mg
Purity： ≥98%
in stock
$1,006.00 $704.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA01EO2D
Chemical Name: MT-DADMe-ImmA
CAS Number: 653592-04-2
Molecular Formula: C13H19N5OS
Molecular Weight: 293.3879
MDL Number: MFCD30738019
SMILES: CSC[C@H]1CN(C[C@@H]1O)Cc1c[nH]c2c1ncnc2N
Properties
Complexity: 334  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 2  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 20  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0  
Literature fold

Title: Transition state analogue inhibitors of human methylthioadenosine phosphorylase and bacterial methylthioadenosine/S-adenosylhomocysteine nucleosidase incorporating acyclic ribooxacarbenium ion mimics.

Journal: Bioorganic & medicinal chemistry20120901

Title: Transition state analogs of 5'-methylthioadenosine nucleosidase disrupt quorum sensing.

Journal: Nature chemical biology20090401

Title: Azetidine based transition state analogue inhibitors of N-ribosyl hydrolases and phosphorylases.

Journal: Journal of medicinal chemistry20080227

Title: Structural rationale for the affinity of pico- and femtomolar transition state analogues of Escherichia coli 5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase.

Journal: The Journal of biological chemistry20050506

Title: Evans GB, et al. Second generation transition state analogue inhibitors of human 5'-methylthioadenosine phosphorylase. J Med Chem. 2005 Jul 14;48(14):4679-89.

Title: Basu I, et al. A transition state analogue of 5'-methylthioadenosine phosphorylase induces apoptosis in head and neck cancers. J Biol Chem. 2007 Jul 20;282(29):21477-86.

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