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5-hydroxy-N-formyl-L-kynurenine

PropertiesImage
MNX_IDMNXM5015 Image of MNXM5015
referencechebi:36407
formulaC11H12N2O5
global charge0
mol weight252.226
InChIKeyLSTOUSIIVKMJBU-QMMMGPOBSA-N
InChIInChI=1S/C11H12N2O5/c12-8(11(17)18)4-10(16)7-3-6(15)1-2-9(7)13-5-14/h1-3,5,8,15H,4,12H2,(H,13,14)(H,17,18)/t8-/m0/s1
SMILESN[C@@H](CC(=O)C1=CC(O)=CC=C1NC=O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C11H12N2O5/c12-8(11(17)18)4-10(16)7-3-6(15)1-2-9(7)13-5-14/h1-3,5,8,15H,4,12H2,(H,13,14)(H,17,18)/t8-/m0/s1 Image of MNXM5015
SMILES (mnx)[CH:1]1=[CH:2][C:9]([N:13]=[CH:5][OH:14])=[C:7]([C:10]([CH2:4][C@@H:8]([C:11](=[O:17])[OH:18])[NH2:12])=[O:16])[CH:3]=[C:6]1[OH:15]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:36407
chebi:36407
LSTOUSIIVKMJBU-QMMMGPOBSA-N 		5-hydroxy-N-formyl-L-kynurenine
(2S)-2-amino-4-(2-formamido-5-hydroxyphenyl)-4-oxobutanoic acid
5-Hydroxy-N-formyl-L-kynurenine

bigg.metabolite:5hoxnfkyn
biggM:5hoxnfkyn
sabiork.compound:8035
sabiorkM:8035
LSTOUSIIVKMJBU-UHFFFAOYSA-N 		5-Hydroxy-N-formylkynurenine
hmdb:HMDB0004086
LSTOUSIIVKMJBU-UHFFFAOYSA-N 		5-Hydroxy-N-formylkynurenine
2-amino-4-(2-formamido-5-hydroxyphenyl)-4-oxobutanoic acid
5-hydroxy-N-formylkynurenine

seed.compound:cpd03359
seedM:cpd03359
kegg.compound:C05648
keggC:C05648
LSTOUSIIVKMJBU-QMMMGPOBSA-N 		5-Hydroxy-N-formylkynurenine
5-Hydroxy-N-formyl-L-kynurenine

vmhM:5hoxnfkyn
vmhmetabolite:5hoxnfkyn
LSTOUSIIVKMJBU-QMMMGPOBSA-N 		5-hydroxy-N-formylkynurenine
2-amino-4-(2-formamido-5-hydroxyphenyl)-4-oxobutanoic acid

CHEBI:2065
chebi:2065
LSTOUSIIVKMJBU-UHFFFAOYSA-N 		5-hydroxy-N-formylkynurenine
2-amino-4-(2-formamido-5-hydroxyphenyl)-4-oxobutanoic acid
5-Hydroxy-N-formylkynurenine

hmdb:HMDB04086
chebi:20578
biggM:M_5hoxnfkyn
keggC:M_C05648
seedM:M_cpd03359
vmhM:M_5hoxnfkyn 		secondary/obsolete/fantasy identifier