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(Q72515288)
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English
N-Carbobenzyloxy-L-aspartic acid 1-benzyl Ester
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
357.12123732800006
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₁₉NO₆
0 references
canonical SMILES
O=C(O)CC(NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1=CC=C(C=C1)COC(=O)[C@H](CC(=O)O)NC(=O)OCC2=CC=CC=C2
0 references
Identifiers
InChI
InChI=1S/C19H19NO6/c21-17(22)11-16(18(23)25-12-14-7-3-1-4-8-14)20-19(24)26-13-15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,20,24)(H,21,22)/t16-/m0/s1
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InChIKey
UYOZWZKJQRBZRH-INIZCTEOSA-N
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CAS Registry Number
4779-31-1
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PubChem CID
6994509
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UniChem compound ID
24072002
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60426388
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DSSTOX compound identifier
DTXCID80377222
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NSC number
150012
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173727
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