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201735-59-3 | L-α-Glutamine, glycyl-N-(4-nitrophenyl)- (9CI)
CAS No: 201735-59-3 Catalog No: AG0027SU MDL No:
Product Description
Catalog Number:
AG0027SU
Chemical Name:
L-α-Glutamine, glycyl-N-(4-nitrophenyl)- (9CI)
CAS Number:
201735-59-3
Molecular Formula:
C13H16N4O6
Molecular Weight:
324.2893
IUPAC Name:
(2S)-5-amino-2-(N-(2-aminoacetyl)-4-nitroanilino)-5-oxopentanoic acid
InChI:
InChI=1S/C13H16N4O6/c14-7-12(19)16(10(13(20)21)5-6-11(15)18)8-1-3-9(4-2-8)17(22)23/h1-4,10H,5-7,14H2,(H2,15,18)(H,20,21)/t10-/m0/s1
InChI Key:
QSFWVFXHYVUKPB-JTQLQIEISA-N
SMILES:
NCC(=O)N([C@H](C(=O)N)CCC(=O)O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
470
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
324.107g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
324.293g/mol
Monoisotopic Mass:
324.107g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
173A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.2
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