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English
beta-Hydroxy-3-(3-methylbut-2-en-1-yl)tyrosine
group of stereoisomers with the chemical formula C₁₄H₁₉NO₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
265.131408088
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₉NO₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C)=CCc1cc(C(O)C(N)C(=O)O)ccc1O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C)=CCc1cc(C(O)[C@H](N)C(=O)O)ccc1O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C14H19NO4/c1-8(2)3-4-9-7-10(5-6-11(9)16)13(17)12(15)14(18)19/h3,5-7,12-13,16-17H,4,15H2,1-2H3,(H,18,19)/t12-,13?/m0/s1
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InChIKey
KTMOYLSEGZRFNV-UEWDXFNNSA-N
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CAS Registry Number
151928-40-4
0 references
PubChem CID
192563
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
65202454
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10934382
0 references
DSSTOX compound identifier
DTXCID201363031
0 references
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