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(Q82676098)
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English
N-(tert-Butoxycarbonyl)-O-(4-formylphenyl)-L-tyrosine
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
385.15253745599995
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₁H₂₃NO₆
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canonical SMILES
CC(C)(C)OC(=O)NC(Cc1ccc(Oc2ccc(C=O)cc2)cc1)C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)OC2=CC=C(C=C2)C=O)C(=O)O
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Identifiers
InChI
InChI=1S/C21H23NO6/c1-21(2,3)28-20(26)22-18(19(24)25)12-14-4-8-16(9-5-14)27-17-10-6-15(13-23)7-11-17/h4-11,13,18H,12H2,1-3H3,(H,22,26)(H,24,25)/t18-/m0/s1
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InChIKey
XSCILGDBIDKOIX-SFHVURJKSA-N
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CAS Registry Number
872187-37-6
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PubChem CID
59751099
1 reference
matched by identifier from
InChIKey
InChIKey
XSCILGDBIDKOIX-SFHVURJKSA-N
UniChem compound ID
44754008
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30732847
1 reference
matched by identifier from
InChIKey
InChIKey
XSCILGDBIDKOIX-SFHVURJKSA-N
DSSTOX compound identifier
DTXCID20683591
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