Home Other Building Blocks l-prolyl-l-glutamic acid

l-prolyl-l-glutamic acid

CAS No.:
67644-00-2
Catalog Number:
AG00649A
Molecular Formula:
C10H16N2O5
Molecular Weight:
244.2444
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Product Description
Catalog Number:
AG00649A
Chemical Name:
l-prolyl-l-glutamic acid
CAS Number:
67644-00-2
Molecular Formula:
C10H16N2O5
Molecular Weight:
244.2444
MDL Number:
MFCD00037872
IUPAC Name:
(2S)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanedioic acid
InChI:
InChI=1S/C10H16N2O5/c13-8(14)4-3-7(10(16)17)12-9(15)6-2-1-5-11-6/h6-7,11H,1-5H2,(H,12,15)(H,13,14)(H,16,17)/t6-,7-/m0/s1
InChI Key:
QLROSWPKSBORFJ-BQBZGAKWSA-N
SMILES:
OC(=O)CC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
244.106g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
244.247g/mol
Monoisotopic Mass:
244.106g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.2  
Literature
Title Journal
Fragmental modeling of hPepT2 and analysis of its binding features by docking studies and pharmacophore mapping. Bioorganic & medicinal chemistry 20110801
Purification, characterization, and gene cloning of glucose-1-phosphatase from Citrobacter braakii. The Journal of general and applied microbiology 20091001
Human PEPT1 pharmacophore distinguishes between dipeptide transport and binding. Journal of medicinal chemistry 20060615
Three-dimensional quantitative structure-activity relationship analyses of beta-lactam antibiotics and tripeptides as substrates of the mammalian H+/peptide cotransporter PEPT1. Journal of medicinal chemistry 20050630
Properties