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Home Other Building Blocks Glycine, L-phenylalanylglycyl-

Glycine, L-phenylalanylglycyl-

CAS No.:
23576-42-3
Catalog Number:
AG002NQI
Molecular Formula:
C13H17N3O4
Molecular Weight:
279.2918
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Product Description
Catalog Number:
AG002NQI
Chemical Name:
Glycine, L-phenylalanylglycyl-
CAS Number:
23576-42-3
Molecular Formula:
C13H17N3O4
Molecular Weight:
279.2918
MDL Number:
MFCD00037785
IUPAC Name:
2-[[2-[[(2S)-2-amino-3-phenylpropanoyl]amino]acetyl]amino]acetic acid
InChI:
InChI=1S/C13H17N3O4/c14-10(6-9-4-2-1-3-5-9)13(20)16-7-11(17)15-8-12(18)19/h1-5,10H,6-8,14H2,(H,15,17)(H,16,20)(H,18,19)/t10-/m0/s1
InChI Key:
NAXPHWZXEXNDIW-JTQLQIEISA-N
SMILES:
N[C@H](C(=O)NCC(=O)NCC(=O)O)Cc1ccccc1
Properties
Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
279.122g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
279.296g/mol
Monoisotopic Mass:
279.122g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.2  
Literature
Title Journal
Limitations of electrospray ionization in the analysis of a heterogeneous mixture of naturally occurring hydrophilic and hydrophobic compounds. Rapid communications in mass spectrometry : RCM 20101115
Double-hybrid density functionals with long-range dispersion corrections: higher accuracy and extended applicability. Physical chemistry chemical physics : PCCP 20070714
The effect of alkaline phosphatase inhibitors on intracellular lipid accumulation in preadipocytes isolated from human mammary tissue. Annals of clinical biochemistry 20060501
Thermal vaporization of biological nanoparticles: fragment-free vacuum ultraviolet photoionization mass spectra of tryptophan, phenylalanine-glycine-glycine, and beta-carotene. The journal of physical chemistry. A 20060216
Structure and IR spectrum of phenylalanyl-glycyl-glycine tripetide in the gas-phase: IR/UV experiments, ab initio quantum chemical calculations, and molecular dynamic simulations. Chemistry (Weinheim an der Bergstrasse, Germany) 20051118
Spectroscopic evidence for gas-phase formation of successive beta-turns in a three-residue peptide chain. Journal of the American Chemical Society 20050209
Properties