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(Q28000018)
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English
5-hydroxy-N-formylkynurenine
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
252.074621484
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₂N₂O₅
0 references
canonical SMILES
c1cc(c(cc1O)C(=O)CC(C(=O)O)N)NC=O
0 references
found in taxon
house mouse
1 reference
stated in
WikiPathways
WikiPathways ID
WP79
Homo sapiens
2 references
stated in
Recon 2.2: from reconstruction to model of human metabolism
stated in
A community-driven global reconstruction of human metabolism.
Identifiers
InChI
InChI=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)
0 references
InChIKey
LSTOUSIIVKMJBU-UHFFFAOYSA-N
1 reference
stated in
ChEBI release 2020-09-01
ChemSpider ID
389615
0 references
PubChem CID
440744
1 reference
matched by identifier from
InChIKey
InChIKey
LSTOUSIIVKMJBU-UHFFFAOYSA-N
ChEBI ID
2065
mapping relation type
exact match
2 references
stated in
ChEBI release 2019-10-02
matched by identifier from
International Chemical Identifier
InChI
InChI=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)
UniChem compound ID
1098373
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID301344147
1 reference
matched by identifier from
InChIKey
InChIKey
LSTOUSIIVKMJBU-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0004086
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LSTOUSIIVKMJBU-UHFFFAOYSA-N
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