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N-formyl-L-kynurenine

PropertiesImage
MNX_IDMNXM727853 Image of MNXM727853
referencechebi:58629
formulaC11H12N2O4
global charge0
mol weight236.227
InChIKeyBYHJHXPTQMMKCA-QMMMGPOBSA-N
InChIInChI=1S/C11H12N2O4/c12-8(11(16)17)5-10(15)7-3-1-2-4-9(7)13-6-14/h1-4,6,8H,5,12H2,(H,13,14)(H,16,17)/t8-/m0/s1
SMILES[NH3+][C@@H](CC(=O)C1=CC=CC=C1NC=O)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C11H12N2O4/c12-8(11(16)17)5-10(15)7-3-1-2-4-9(7)13-6-14/h1-4,6,8H,5,12H2,(H,13,14)(H,16,17)/t8-/m0/s1 Image of MNXM727853
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:9]([N:13]=[CH:6][OH:14])[C:7]([C:10]([CH2:5][C@@H:8]([C:11](=[O:16])[OH:17])[NH2:12])=[O:15])=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58629
chebi:58629
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		N-formyl-L-kynurenine
(2S)-2-azaniumyl-4-(2-formamidophenyl)-4-oxobutanoate
N-formyl-L-kynurenine zwitterion

sabiork.compound:6188
sabiorkM:6188
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		Formylkynurenine
N-Formylkynurenine
hmdb:HMDB0060485
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		L-Formylkynurenine
(2S)-2-amino-4-(2-formamidophenyl)-4-oxobutanoic acid
3-(2-Formamidobenzoyl)-L-alanine
N'-formylkynurenine
N-Formyl-L-kynurenine
N-Formylkynurenine

sabiork.compound:6316
sabiorkM:6316
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		L-Formylkynurenine
N-Formyl-L-kynurenine

kegg.compound:C02700
keggC:C02700
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		L-Formylkynurenine
N-Formyl-L-kynurenine
N-Formylkynurenine

seed.compound:cpd27595
seedM:cpd27595
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		N-Formyl-L-kynurenine
N-formylkynurenine

seed.compound:cpd01749
seedM:cpd01749
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		N-Formylkynurenine
L-Formylkynurenine
Lfmkynr
N-Formyl-L-kynurenine
N-formyl-D-kynurenine

vmhM:Lfmkynr
vmhmetabolite:Lfmkynr
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		N-formyl-L-kynurenine
(2S)-2-amino-4-(2-formamidophenyl)-4-oxobutanoic acid

CHEBI:30249
chebi:30249
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		N-formyl-L-kynurenine
(2S)-2-amino-4-(2-formamidophenyl)-4-oxobutanoic acid
3-(2-formamidobenzoyl)-L-alanine
L-Formylkynurenine
N'-formylkynurenine
N-Formyl-L-kynurenine
N-Formylkynurenine
N-formylkynurenine

metacyc.compound:N-FORMYLKYNURENINE
metacycM:N-FORMYLKYNURENINE
BYHJHXPTQMMKCA-QMMMGPOBSA-N 		N-formyl-L-kynurenine
N-formylkynurenine

hmdb:HMDB60485
chebi:12505
chebi:13100
chebi:21712
chebi:6215
keggC:M_C02700
seedM:M_cpd01749
seedM:M_cpd27595
vmhM:M_Lfmkynr 		secondary/obsolete/fantasy identifier