Home Other Building Blocks 4-carbamoyl-2-acetamidobutanoic acid

4-carbamoyl-2-acetamidobutanoic acid

CAS No.:
5817-09-4
Catalog Number:
AG01A9QP
Molecular Formula:
C7H12N2O4
Molecular Weight:
188.1812
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Product Description
Catalog Number:
AG01A9QP
Chemical Name:
4-carbamoyl-2-acetamidobutanoic acid
CAS Number:
5817-09-4
Molecular Formula:
C7H12N2O4
Molecular Weight:
188.1812
MDL Number:
MFCD01882990
IUPAC Name:
2-acetamido-5-amino-5-oxopentanoic acid
InChI:
InChI=1S/C7H12N2O4/c1-4(10)9-5(7(12)13)2-3-6(8)11/h5H,2-3H2,1H3,(H2,8,11)(H,9,10)(H,12,13)
InChI Key:
KSMRODHGGIIXDV-UHFFFAOYSA-N
SMILES:
NC(=O)CCC(C(=O)O)NC(=O)C
NSC Number:
186896
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.08g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
188.183g/mol
Monoisotopic Mass:
188.08g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4  
Literature
Title Journal
Understanding carbamoyl-phosphate synthetase I (CPS1) deficiency by using expression studies and structure-based analysis. Human mutation 20100701
N-acetyl-L-glutamine, a liquid-stable source of glutamine, partially prevents changes in body weight and on intestinal immunity induced by protein energy malnutrition in pigs. Digestive diseases and sciences 20070301
Absorption of enterally administered N-acetyl-l-glutamine versus glutamine in pigs. Clinical nutrition (Edinburgh, Scotland) 20041201
N-acetyl functions and acetate detected by nuclear magnetic resonance spectroscopy of urine to detect renal dysfunction following aminoglycoside and/or glycopeptide antibiotic therapy. Nephron. Physiology 20040101
Properties