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English
N~2~-Acetyl-N-(4-acetylphenyl)-L-alpha-asparagine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
292.105921612
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₄H₁₆N₂O₅
0 references
canonical SMILES
CC(=O)NC(CC(=O)O)C(=O)Nc1ccc(C(C)=O)cc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(=O)C1=CC=C(C=C1)NC(=O)[C@H](CC(=O)O)NC(=O)C
0 references
Identifiers
InChI
InChI=1S/C14H16N2O5/c1-8(17)10-3-5-11(6-4-10)16-14(21)12(7-13(19)20)15-9(2)18/h3-6,12H,7H2,1-2H3,(H,15,18)(H,16,21)(H,19,20)/t12-/m0/s1
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InChIKey
LRHPUJHTQMJUOE-LBPRGKRZSA-N
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CAS Registry Number
61980-03-8
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PubChem CID
71390861
1 reference
matched by identifier from
InChIKey
InChIKey
LRHPUJHTQMJUOE-LBPRGKRZSA-N
UniChem compound ID
44478370
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70812758
1 reference
matched by identifier from
InChIKey
InChIKey
LRHPUJHTQMJUOE-LBPRGKRZSA-N
DSSTOX compound identifier
DTXCID80763500
0 references
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