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(Q82313706)
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CTK1D0447
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
223.120843404
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₂H₁₇NO₃
0 references
canonical SMILES
COC(=O)CC(N)COCc1ccccc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COC(=O)C[C@H](COCC1=CC=CC=C1)N
0 references
Identifiers
InChI
InChI=1S/C12H17NO3/c1-15-12(14)7-11(13)9-16-8-10-5-3-2-4-6-10/h2-6,11H,7-9,13H2,1H3/t11-/m1/s1
0 references
InChIKey
ADCAWILRZRUZIT-LLVKDONJSA-N
0 references
CAS Registry Number
497847-07-1
0 references
PubChem CID
12184746
1 reference
matched by identifier from
InChIKey
InChIKey
ADCAWILRZRUZIT-LLVKDONJSA-N
UniChem compound ID
62959917
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20479592
1 reference
matched by identifier from
InChIKey
InChIKey
ADCAWILRZRUZIT-LLVKDONJSA-N
DSSTOX compound identifier
DTXCID80430402
0 references
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