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(Q82853516)
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English
Methyl (3S)-2-(benzylamino)-2-({[tert-butyl(dimethyl)silyl]oxy}methyl)-3-hydroxy-4-methylpentanoate (non-preferred name)
group of stereoisomers with the chemical formula C₂₁H₃₇NO₄Si
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
395.24918519399995
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₇NO₄Si
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COC(=O)C(CO[Si](C)(C)C(C)(C)C)(NCc1ccccc1)C(O)C(C)C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COC(=O)C(CO[Si](C)(C)C(C)(C)C)(NCc1ccccc1)[C@@H](O)C(C)C
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C21H37NO4Si/c1-16(2)18(23)21(19(24)25-6,15-26-27(7,8)20(3,4)5)22-14-17-12-10-9-11-13-17/h9-13,16,18,22-23H,14-15H2,1-8H3/t18-,21?/m0/s1
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InChIKey
LBFRXWHXJRXEMF-YMXDCFFPSA-N
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CAS Registry Number
145451-92-9
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PubChem CID
71750219
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
69954926
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50858018
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DSSTOX compound identifier
DTXCID90808759
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