L-Kynurenine

C10H12N2O3CAS 2922-83-0208.22 g/mol

H2NONH2OHO
Carboxylic acidKetonePrimary amine

Properties

Molecular formula
C10H12N2O3
Molar mass
208.22 g/mol
Exact mass
208.0848 Da
Melting point
219 °C (decomposes)
logP
0.25Crippen estimate
Polar surface area
106.4 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
4
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
2922-83-0
SMILES
Nc1ccccc1C(=O)C[C@H](N)C(=O)O
InChIKey
YGPSJZOEDVAXAB-QMMMGPOBSA-N
InChI
InChI=1S/C10H12N2O3/c11-7-4-2-1-3-6(7)9(13)5-8(12)10(14)15/h1-4,8H,5,11-12H2,(H,14,15)/t8-/m0/s1

Weigh it out

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

Names and synonyms

9 names
  • Benzenebutanoic acid, α,2-diamino-γ-oxo-, (αS)-
  • Alanine, 3-anthraniloyl-, L-
  • Benzenebutanoic acid, α,2-diamino-γ-oxo-, (S)-
  • (αS)-α,2-Diamino-γ-oxobenzenebutanoic acid
  • L-3-(o-Aminobenzoyl)alanine
  • Kynurenine
  • Kynurenin
  • 3-Anthraniloylalanine
  • (2S)-4-(2-Aminophenyl)-2-azaniumyl-4-oxobutanoate

Work with L-Kynurenine

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Similar compounds

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

Same formula

Elsewhere