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537049-40-4,MFCD18452824
Catalog No.:AA0037LE

537049-40-4 | Tubacin

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
95%
in stock  
$85.00   $60.00
- +
100mg
98.5% by HPLC
in stock  
$8,100.00   $5,670.00
- +
500mg
98.5% by HPLC
in stock  
$26,020.00   $18,214.00
- +
1000mg
98.5% by HPLC
in stock  
$41,600.00   $29,120.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0037LE
Chemical Name:
Tubacin
CAS Number:
537049-40-4
Molecular Formula:
C41H43N3O7S
Molecular Weight:
721.8610
MDL Number:
MFCD18452824
SMILES:
ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)[C@H]1O[C@@H](CSc2nc(c(o2)c2ccccc2)c2ccccc2)C[C@H](O1)c1ccc(cc1)CO
Properties
Properties
 
Form:
Solid  
MP:
155 - 157°C  
Storage:
Keep in dry area;-20 ℃;  

Computed Properties
 
Complexity:
1060  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Heavy Atom Count:
52  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
4  
Rotatable Bond Count:
16  
XLogP3:
6.3  

Literature

Title: Butler KV, et al. Rational design and simple chemistry yield a superior, neuroprotective HDAC6 inhibitor, tubastatin A. J Am Chem Soc. 2010 Aug 11;132(31):10842-6.

Title: Hideshima T, et al. Small-molecule inhibition of proteasome and aggresome function induces synergistic antitumor activity in multiple myeloma. Proc Natl Acad Sci U S A. 2005 Jun 14;102(24):8567-72. Epub 2005 Jun 3.

Title: Lu CY, et al. Tubacin, an HDAC6 Selective Inhibitor, Reduces the Replication of the Japanese Encephalitis Virus via the Decrease of Viral RNA Synthesis. Int J Mol Sci. 2017 May 1;18(5).

Title: Severin Lechner, et al. Target deconvolution of HDAC pharmacopoeia reveals MBLAC2 as common off-target. Nat Chem Biol. 2022 Apr 28.

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SDS
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