chempirical

N-Acetyl-L-glutamic acid

C7H11NO5CAS 1188-37-0189.17 g/mol

Open in Covalent MOL file
ONHOOHOHO
Carboxylic acid

Properties

Molecular formula
C7H11NO5
Molar mass
189.17 g/mol
Exact mass
189.0637 Da
Melting point
195 °C
logP
0.28Crippen estimate
Polar surface area
107.2 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
1188-37-0
SMILES
CC(O)=N[C@@H](CCC(=O)O)C(=O)O
InChIKey
RFMMMVDNIPUKGG-YFKPBYRVSA-N
InChI
InChI=1S/C7H11NO5/c1-4(9)8-5(7(12)13)2-3-6(10)11/h5H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13)/t5-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • L-Glutamic acid, N-acetyl-
  • Glutamic acid, N-acetyl-, L-
  • N-Acetylglutamic acid
  • N-Acetyl-S-glutamic acid
  • Acetylglutamic acid
  • L-N-Acetylglutamic acid
  • α-(N-Acetyl)-L-glutamic acid
  • N-Acetyl-L-glutaminic acid
  • (2S)-2-Acetamidopentanedioic acid

Work with N-Acetyl-L-glutamic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Acetylaspartic acid2545-40-671 % similar N-Acetyl-L-aspartic acid997-55-771 % similar Aceglutamide2490-97-368 % similar 2-(Acetylamino)butanoic acid7211-57-662 % similar N-Acetylmethionine1115-47-561 % similar N-Acetyl-D-methionine1509-92-861 % similar N-Acetyl-L-methionine65-82-761 % similar N-Acetyl-dl-serine97-14-360 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Oxa-6-azaspiro[3,3]heptane oxalic acid salt1159599-99-1 N-Acetylglutamic acid5817-08-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook