Terminology Service for NFDI4Health
3-nitrotyramine zwitterion
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http://purl.obolibrary.org/obo/CHEBI_71286
A zwitterion obtained by transfer of a proton from the phenol to the amino group of 3-nitrotyramine; major species at pH 7.3
Term info
Label
3-nitrotyramine zwitterion
Synonyms
- 4-(2-azaniumylethyl)-2-nitrophenolate
Subsets
3_STAR
charge
0
formula
C8H10N2O3
has obo namespace
chebi_ontology
has related synonym
3-nitrotyramine, 4-(2-aminoethyl)-2-nitrophenol, 4-(2-ammonioethyl)-2-nitrophenolate
id
CHEBI:71286
inchi
InChI=1S/C8H10N2O3/c9-4-3-6-1-2-8(11)7(5-6)10(12)13/h1-2,5,11H,3-4,9H2
inchikey
IUCYCHQMRZWPGT-UHFFFAOYSA-N
mass
182.17660
monoisotopicmass
182.06914
smiles
[NH3+]CCc1ccc([O-])c(c1)N(=O)=O
Term relations
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