Home Other Building Blocks 3-(2-Thienyl)-DL-alanine

3-(2-Thienyl)-DL-alanine

CAS No.:
2021-58-1
Catalog Number:
AG002829
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$169
- +
25g
98%
In Stock USA
United States
$732
- +
100g
98%
In Stock USA
United States
$1988
- +
Product Description
Catalog Number:
AG002829
Chemical Name:
3-(2-Thienyl)-DL-alanine
CAS Number:
2021-58-1
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
MDL Number:
MFCD00005459
IUPAC Name:
2-amino-3-thiophen-2-ylpropanoic acid
InChI:
InChI=1S/C7H9NO2S/c8-6(7(9)10)4-5-2-1-3-11-5/h1-3,6H,4,8H2,(H,9,10)
InChI Key:
WTOFYLAWDLQMBZ-UHFFFAOYSA-N
SMILES:
OC(=O)C(Cc1cccs1)N
NSC Number:
754
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.035g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
171.214g/mol
Monoisotopic Mass:
171.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7  
Literature
Title Journal
Self-assembly of a designed amyloid peptide containing the functional thienylalanine unit. The journal of physical chemistry. B 20100819
2.0A resolution crystal structures of the ternary complexes of human phenylalanine hydroxylase catalytic domain with tetrahydrobiopterin and 3-(2-thienyl)-L-alanine or L-norleucine: substrate specificity and molecular motions related to substrate binding. Journal of molecular biology 20031031
Substrate-induced conformational transition in human phenylalanine hydroxylase as studied by surface plasmon resonance analyses: the effect of terminal deletions, substrate analogues and phosphorylation. The Biochemical journal 20030201
Crystal structure of the ternary complex of the catalytic domain of human phenylalanine hydroxylase with tetrahydrobiopterin and 3-(2-thienyl)-L-alanine, and its implications for the mechanism of catalysis and substrate activation. Journal of molecular biology 20020726
Construction of a Bacillus subtilis (natto) with high productivity of vitamin K2 (menaquinone-7) by analog resistance. Bioscience, biotechnology, and biochemistry 20010901
Properties