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CHEBI:140994 - 4-nitrophenyl sulfate
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ChEBI Name
4-nitrophenyl sulfate
ChEBI ID
CHEBI:140994
Definition
An aryl sulfate oxoanion resulting from the deprotonation of the sulfooxy group of 4-nitrophenyl hydrogen sulfate. The major microspecies at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Anne Morgat
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Formula
C6H4NO6S
Net Charge
-1
Average Mass
218.165
Monoisotopic Mass
217.97648
InChI
InChI=1S/C6H5NO6S/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12/h1-4H,(H,10,11,12)/p-1
InChIKey
JBGHTSSFSSUKLR-UHFFFAOYSA-M
SMILES
C1=C(C=CC(=C1)[N+](=O)[O-])OS([O-])(=O)=O
ChEBI Ontology
Outgoing
4-nitrophenyl sulfate (
CHEBI:140994
)
has functional parent
4-nitrophenol (
CHEBI:16836
)
4-nitrophenyl sulfate (
CHEBI:140994
)
is a
aryl sulfate oxoanion (
CHEBI:139371
)
4-nitrophenyl sulfate (
CHEBI:140994
)
is conjugate base of
4-nitrophenyl hydrogen sulfate (
CHEBI:35422
)
Incoming
4-nitrophenyl hydrogen sulfate (
CHEBI:35422
)
is conjugate acid of
4-nitrophenyl sulfate (
CHEBI:140994
)
IUPAC Names
4-nitrophenyl sulfate
p
-nitrophenyl sulfate
Synonym
Source
4-nitrophenyl sulfate
UniProt
Citation
Type
Source
19036922
PubMed citation
SUBMITTER
Last Modified
11 June 2018