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(Q83058458)
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Ethyl DL-threoninate hydrochloride
chemical compound
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
183.066220988
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₆H₁₄ClNO₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCOC(=O)C(N)C(C)O.Cl
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCOC(=O)[C@@H](N)C(C)O.Cl
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C6H13NO3.ClH/c1-3-10-6(9)5(7)4(2)8;/h4-5,8H,3,7H2,1-2H3;1H/t4?,5-;/m0./s1
0 references
InChIKey
WHKKNTASOQMDMH-YKXIHYLHSA-N
0 references
CAS Registry Number
33368-36-4
0 references
PubChem CID
20848852
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
47885971
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10186980
0 references
DSSTOX compound identifier
DTXCID50109471
0 references
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