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57105-39-2

57105-39-2 | N-(3-Indolylacetyl)-L-alanine

CAS No: 57105-39-2 Catalog No: AG003SB2 MDL No:

Product Description

Catalog Number:
AG003SB2
Chemical Name:
N-(3-Indolylacetyl)-L-alanine
CAS Number:
57105-39-2
IUPAC Name:
(2S)-2-[[2-(1H-indol-3-yl)acetyl]amino]propanoic acid
InChI:
InChI=1S/C13H14N2O3/c1-8(13(17)18)15-12(16)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7-8,14H,6H2,1H3,(H,15,16)(H,17,18)/t8-/m0/s1
InChI Key:
FBDCJLXTUCMFLF-QMMMGPOBSA-N

Properties

Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
246.1g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
246.266g/mol
Monoisotopic Mass:
246.1g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

Literature

Title Journal
Synthesis and biological activity of amino acid conjugates of abscisic acid. Bioorganic & medicinal chemistry 20110301
Auxin amidohydrolases from Brassica rapa cleave the alanine conjugate of indolepropionic acid as a preferable substrate: a biochemical and modeling approach. Plant & cell physiology 20090901
X-ray structure of ILL2, an auxin-conjugate amidohydrolase from Arabidopsis thaliana. Proteins 20090101
Characterization of an Arabidopsis enzyme family that conjugates amino acids to indole-3-acetic acid. The Plant cell 20050201

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