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English
N-acetylkynuramine
chemical compound
acetylkynuramine
N-[3-(2-aminophenyl)-3-oxopropyl]acetamide
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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chemical structure
N-Acetylkynuramine.svg
520 × 260; 11 KB
0 references
mass
206.105527688
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₄N₂O₂
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canonical SMILES
CC(=O)NCCC(=O)C1=CC=CC=C1N
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found in taxon
Janibacter limosus
1 reference
stated in
Helquinoline, a new tetrahydroquinoline antibiotic from Janibacter limosus Hel 1+.
Identifiers
InChI
InChI=1S/C11H14N2O2/c1-8(14)13-7-6-11(15)9-4-2-3-5-10(9)12/h2-5H,6-7,12H2,1H3,(H,13,14)
0 references
InChIKey
YDSXWKCTDWHLBK-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
21777754
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
21777754
language of work or name
English
CAS Registry Number
656250-11-2
0 references
PubChem CID
21777754
2 references
stated in
PubChem
PubChem CID
21777754
language of work or name
English
matched by identifier from
InChIKey
InChIKey
YDSXWKCTDWHLBK-UHFFFAOYSA-N
ChEBI ID
199133
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C11H14N2O2/c1-8(14)13-7-6-11(15)9-4-2-3-5-10(9)12/h2-5H,6-7,12H2,1H3,(H,13,14)
UniChem compound ID
54377578
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10617921
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
YDSXWKCTDWHLBK-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00568675
0 references
Natural Product Atlas ID
NPA001844
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YDSXWKCTDWHLBK-UHFFFAOYSA-N
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