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(Q82599258)
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English
(2R)-N-Benzyl-2,4-dihydroxy-3,3-dimethylbutanamide
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
237.136493468
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₃H₁₉NO₃
0 references
canonical SMILES
CC(C)(CO)C(O)C(=O)NCc1ccccc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C)(CO)[C@H](C(=O)NCC1=CC=CC=C1)O
0 references
Identifiers
InChI
InChI=1S/C13H19NO3/c1-13(2,9-15)11(16)12(17)14-8-10-6-4-3-5-7-10/h3-7,11,15-16H,8-9H2,1-2H3,(H,14,17)/t11-/m0/s1
0 references
InChIKey
MADXIXXELGXZLD-NSHDSACASA-N
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CAS Registry Number
88308-87-6
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PubChem CID
46830479
1 reference
matched by identifier from
InChIKey
InChIKey
MADXIXXELGXZLD-NSHDSACASA-N
UniChem compound ID
32630998
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40676309
1 reference
matched by identifier from
InChIKey
InChIKey
MADXIXXELGXZLD-NSHDSACASA-N
DSSTOX compound identifier
DTXCID40627058
0 references
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