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CHEBI:71233 - 3-nitrotyramine
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ChEBI Ontology
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ChEBI Name
3-nitrotyramine
ChEBI ID
CHEBI:71233
Definition
Tyramine substituted at position 3 by a nitro group.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Maria Jose
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Formula
C8H10N2O3
Net Charge
0
Average Mass
182.17660
Monoisotopic Mass
182.06914
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
SMILES
NCCc1ccc(O)c(c1)[N+]([O-])=O
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
3-nitrotyramine (
CHEBI:71233
)
has functional parent
tyramine (
CHEBI:15760
)
3-nitrotyramine (
CHEBI:71233
)
is a
2-nitrophenols (
CHEBI:86421
)
3-nitrotyramine (
CHEBI:71233
)
is a
tyramines (
CHEBI:27175
)
3-nitrotyramine (
CHEBI:71233
)
is tautomer of
3-nitrotyramine zwitterion (
CHEBI:71286
)
Incoming
3-nitrotyramine zwitterion (
CHEBI:71286
)
is tautomer of
3-nitrotyramine (
CHEBI:71233
)
IUPAC Name
4-(2-aminoethyl)-2-nitrophenol
Synonyms
Sources
1-amino-2-(3-nitro-4-hydroxyphenyl)ethane
ChEBI
4-hydroxy-3-nitrophenethylamine
ChEBI
Registry Number
Type
Source
2837315
Reaxys Registry Number
Reaxys
Citation
Type
Source
18658270
PubMed citation
SUBMITTER
Last Modified
21 October 2015