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N-formyl-L-kynurenine zwitterion
chemical compound
(2S)-2-azaniumyl-4-(2-formamidophenyl)-4-oxobutanoate
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
N-formylkynurenine
1 reference
based on heuristic
inferred from InChIKey
part of
arylformamidase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
tryptophan 2,3-dioxygenase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
mass
236.079706864
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
N-formyl-D-kynurenine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
N-formyl-D-kynurenine zwitterion
1 reference
based on heuristic
inferred from InChI
N-formyl-L-kynurenine
1 reference
based on heuristic
inferred from InChI
tautomer of
N-formyl-L-kynurenine
1 reference
stated in
ChEBI release 2021-03-01
chemical formula
C₁₁H₁₂N₂O₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NC(CC(=O)c1ccccc1N=CO)C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
N[C@@H](CC(=O)c1ccccc1NC=O)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=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
1 reference
stated in
ChEBI release 2021-03-01
InChIKey
BYHJHXPTQMMKCA-QMMMGPOBSA-N
1 reference
stated in
ChEBI release 2021-03-01
ChEBI ID
58629
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=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
30249
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=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
SureChEMBL ID
SCHEMBL145723
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BYHJHXPTQMMKCA-QMMMGPOBSA-N
Human Metabolome Database ID
HMDB0060485
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BYHJHXPTQMMKCA-QMMMGPOBSA-N
UNII
PS20W0733S
1 reference
matched by identifier from
InChIKey
InChIKey
BYHJHXPTQMMKCA-QMMMGPOBSA-N
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