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205252-36-4 | L-Glutamine, D-alanyl-
CAS No: 205252-36-4 Catalog No: AG0029YY MDL No:
Product Description
Catalog Number:
AG0029YY
Chemical Name:
L-Glutamine, D-alanyl-
CAS Number:
205252-36-4
Molecular Formula:
C8H15N3O4
Molecular Weight:
217.2224
IUPAC Name:
(2S)-5-amino-2-[[(2R)-2-aminopropanoyl]amino]-5-oxopentanoic acid
InChI:
InChI=1S/C8H15N3O4/c1-4(9)7(13)11-5(8(14)15)2-3-6(10)12/h4-5H,2-3,9H2,1H3,(H2,10,12)(H,11,13)(H,14,15)/t4-,5+/m1/s1
InChI Key:
HJCMDXDYPOUFDY-UHNVWZDZSA-N
SMILES:
NC(=O)CC[C@@H](C(=O)O)NC(=O)[C@H](N)C
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
217.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
217.225g/mol
Monoisotopic Mass:
217.106g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
136A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.4
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