KYN
(2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid
Find entries where: KYN
is present as a standalone ligand in 11 entries
is present in a polymer sequence 8 entries
Chemical Component Summary | |
|---|---|
| Name | (2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid |
| Synonyms | L-KYNURENINE |
| Identifiers | (2S)-4-(2-aminophenyl)-2-azanyl-4-oxidanylidene-butanoic acid |
| Formula | C10 H12 N2 O3 |
| Molecular Weight | 208.214 |
| Type | L-PEPTIDE LINKING |
| Isomeric SMILES | c1ccc(c(c1)C(=O)C[C@@H](C(=O)O)N)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 |
| InChIKey | YGPSJZOEDVAXAB-QMMMGPOBSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 27 |
| Chiral Atom Count | 1 |
| Bond Count | 27 |
| Aromatic Bond Count | 6 |
Drug Info: DrugBank
| DrugBank ID | DB02070 |
|---|---|
| Name | Kynurenine |
| Groups | experimental |
| Synonyms |
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| Categories |
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| CAS number | 2922-83-0 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 161166, 6971029 |
| ChEMBL | CHEMBL498416 |
| ChEBI | CHEBI:57959, CHEBI:16946 |
| CCDC/CSD | WOCJON |
