Properties
Canonical smiles
C1=CC=C(C(=C1)C(=O)CC(C(=O)O)N)N
Canonical smiles
C1=CC=C(C(=C1)C(=O)CC(C(=O)O)N)N
Cas registry number
2922-83-0
Chebi id
16946, 57959
Chembl id
CHEMBL498416
Chemical formula
C₁₀H₁₂N₂O₃
Chemical formula
C₁₀H₁₂N₂O₃
Chemspider id
141580
Drugbank id
DB02070
Dsstox substance id
DTXSID101031182
Found in taxon
Homo sapiens, Bombyx mori, Caenorhabditis elegans
Freebase id
/m/0bq97t, /m/02kcvlj
Gran enciclopèdia catalana id
quinurenina
Gran enciclopèdia catalana id (former scheme)
0136380
Has part(s)
oxygen, carbon
Human metabolome database id
HMDB0000684
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
Isomeric smiles
C1=CC=C(C(=C1)C(=O)C[C@@H](C(=O)O)N)N
Isomeric smiles
C1=CC=C(C(=C1)C(=O)C[C@@H](C(=O)O)N)N
Kegg id
C00328
Mass
unit: dalton, amount: 208.084792244
Mass
unit: Q483261, amount: +208.084792244
Massbank accession id
MSBNK-Fiocruz-FIO00638, MSBNK-Fiocruz-FIO00639, MSBNK-Fiocruz-FIO00640, MSBNK-Fiocruz-FIO00641, MSBNK-Fiocruz-FIO00642, MSBNK-Keio_Univ-KO003267, MSBNK-Keio_Univ-KO003268, MSBNK-Keio_Univ-KO003269, MSBNK-Keio_Univ-KO003270, MSBNK-Keio_Univ-KO003271, MSBNK-Keio_Univ-KO009016, MSBNK-Keio_Univ-KO009017, MSBNK-Keio_Univ-KO009018, MSBNK-Keio_Univ-KO009019, MSBNK-Keio_Univ-KO009020, MSBNK-Metabolon-MT000014, MSBNK-Osaka_Univ-OUF00313
Mesh descriptor id
D007737
Mesh tree code
D12.125.608
Microsoft academic id (discontinued)
2777503454
Openalex id
C2777503454
Part of
L-kynurenine metabolic process, L-kynurenine catabolic process
Pdb ligand id
KYN
Probes and drugs id
PD008579
Pubchem cid
161166, 6971029
Splash
splash10-00ds-0900000000-19c838d5478f570ffb50, splash10-00r2-0900000000-275bef748b04de950909, splash10-01ba-1900000000-64ee050c4ce47392ea0e, splash10-01bd-2900000000-069fda767e994e9546a0, splash10-0a4i-0790000000-3fa45266412288bf1c62, splash10-0007-3900000000-a66f45aff81960af7575, splash10-00xv-5900000000-37f1dd3063f8363f8d71, splash10-00r7-7900000000-4f3a2d7ad57bfa7eeb24, splash10-0006-9400000000-d5d45364462a730de436, splash10-0006-0900000000-35275991e526ffdfcaf6, splash10-0f6w-2900000000-b2d4f361ffee9fd93bb7, splash10-004j-0900000000-62a4a4e9fd573d659bae, splash10-000i-0900000000-2441a358973abdb063da, splash10-0udi-0900000000-dc4fee4751d629575157, splash10-0006-0900000000-18c5c7fabe5faeb6acfe, splash10-014l-0931000000-29fa7c323b035cb399d3, splash10-0006-0900000000-f0125cc8b7c09ecbbe28, splash10-0006-0900000000-4b30e566363c5766417e, splash10-0059-0890000000-b303ab5a711757452bbb, splash10-0059-0890000000-ebef4ff413062f76748d, splash10-00dj-0139000000-b07d47ce53f6d23a8757, splash10-00dj-0139000000-a8aeab6d3b4cb521431d, splash10-0006-1900000000-0bc594f5442f2de3cdfe, splash10-0006-1900000000-4636ecc004b173f0b8f7, splash10-053r-0193000000-00dece45477a20790bba, splash10-0a4i-0291000000-10de510486b8e81c3fa4, splash10-0a4i-0490000000-a57956b1d15a265629df, splash10-014l-0931000000-a43ae0acafac266101c4, splash10-0006-1910000000-fdc25d09b4da4b1d7657, splash10-01bd-5900000000-c18e10be7e029474cf03, splash10-0006-2910000000-366ce08b5736d68dfad0, splash10-00kf-9300000000-0f8238d38819f6f30d12
Stereoisomer of
L-kynurenine zwitterion, D-kynurenine
Stereoisomer of
L-kynurenine zwitterion, D-kynurenine
Subject has role
primary metabolite
Surechembl id
20875
Tautomer of
L-kynurenine zwitterion
Tautomer of
L-kynurenine zwitterion
Umls cui
C0022818
Unichem compound id
231465
Unii
02JW4J5R44
External References (26)
Cas registry number
2922-83-0
Chebi id
16946, 57959
Chembl id
CHEMBL498416
Chemspider id
141580
Drugbank id
DB02070
Dsstox substance id
DTXSID101031182
Freebase id
/m/0bq97t, /m/02kcvlj
Gran enciclopèdia catalana id
quinurenina
Gran enciclopèdia catalana id (former scheme)
0136380
Human metabolome database id
HMDB0000684
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
Kegg id
C00328
Massbank accession id
MSBNK-Fiocruz-FIO00638, MSBNK-Fiocruz-FIO00639, MSBNK-Fiocruz-FIO00640, MSBNK-Fiocruz-FIO00641, MSBNK-Fiocruz-FIO00642, MSBNK-Keio_Univ-KO003267, MSBNK-Keio_Univ-KO003268, MSBNK-Keio_Univ-KO003269, MSBNK-Keio_Univ-KO003270, MSBNK-Keio_Univ-KO003271, MSBNK-Keio_Univ-KO009016, MSBNK-Keio_Univ-KO009017, MSBNK-Keio_Univ-KO009018, MSBNK-Keio_Univ-KO009019, MSBNK-Keio_Univ-KO009020, MSBNK-Metabolon-MT000014, MSBNK-Osaka_Univ-OUF00313
Mesh descriptor id
D007737
Mesh tree code
D12.125.608
Microsoft academic id (discontinued)
2777503454
Openalex id
C2777503454
Pdb ligand id
KYN
Probes and drugs id
PD008579
Pubchem cid
161166, 6971029
Splash
splash10-00ds-0900000000-19c838d5478f570ffb50, splash10-00r2-0900000000-275bef748b04de950909, splash10-01ba-1900000000-64ee050c4ce47392ea0e, splash10-01bd-2900000000-069fda767e994e9546a0, splash10-0a4i-0790000000-3fa45266412288bf1c62, splash10-0007-3900000000-a66f45aff81960af7575, splash10-00xv-5900000000-37f1dd3063f8363f8d71, splash10-00r7-7900000000-4f3a2d7ad57bfa7eeb24, splash10-0006-9400000000-d5d45364462a730de436, splash10-0006-0900000000-35275991e526ffdfcaf6, splash10-0f6w-2900000000-b2d4f361ffee9fd93bb7, splash10-004j-0900000000-62a4a4e9fd573d659bae, splash10-000i-0900000000-2441a358973abdb063da, splash10-0udi-0900000000-dc4fee4751d629575157, splash10-0006-0900000000-18c5c7fabe5faeb6acfe, splash10-014l-0931000000-29fa7c323b035cb399d3, splash10-0006-0900000000-f0125cc8b7c09ecbbe28, splash10-0006-0900000000-4b30e566363c5766417e, splash10-0059-0890000000-b303ab5a711757452bbb, splash10-0059-0890000000-ebef4ff413062f76748d, splash10-00dj-0139000000-b07d47ce53f6d23a8757, splash10-00dj-0139000000-a8aeab6d3b4cb521431d, splash10-0006-1900000000-0bc594f5442f2de3cdfe, splash10-0006-1900000000-4636ecc004b173f0b8f7, splash10-053r-0193000000-00dece45477a20790bba, splash10-0a4i-0291000000-10de510486b8e81c3fa4, splash10-0a4i-0490000000-a57956b1d15a265629df, splash10-014l-0931000000-a43ae0acafac266101c4, splash10-0006-1910000000-fdc25d09b4da4b1d7657, splash10-01bd-5900000000-c18e10be7e029474cf03, splash10-0006-2910000000-366ce08b5736d68dfad0, splash10-00kf-9300000000-0f8238d38819f6f30d12
Surechembl id
20875
Umls cui
C0022818
Unichem compound id
231465
Unii
02JW4J5R44