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87092-47-5

87092-47-5 | L-Glutamic acid, L-cysteinyl-

CAS No: 87092-47-5 Catalog No: AG004UW7 MDL No:

Product Description

Catalog Number:
AG004UW7
Chemical Name:
L-Glutamic acid, L-cysteinyl-
CAS Number:
87092-47-5
Molecular Formula:
C8H14N2O5S
Molecular Weight:
250.2722
IUPAC Name:
(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]pentanedioic acid
InChI:
InChI=1S/C8H14N2O5S/c9-4(3-16)7(13)10-5(8(14)15)1-2-6(11)12/h4-5,16H,1-3,9H2,(H,10,13)(H,11,12)(H,14,15)/t4-,5-/m0/s1
InChI Key:
BUXAPSQPMALTOY-WHFBIAKZSA-N
SMILES:
SC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)N

Properties

Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
250.062g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
250.269g/mol
Monoisotopic Mass:
250.062g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.4  

Literature

Title Journal
Analysis of BNP7787 thiol-disulfide exchange reactions in phosphate buffer and human plasma using microscale electrochemical high performance liquid chromatography. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20090401

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