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CHEBI:133706 - propyl 4-hydroxybenzoate sulfate
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ChEBI Name
propyl 4-hydroxybenzoate sulfate
ChEBI ID
CHEBI:133706
Definition
A benzoate ester that is propyl 4-hydroxybenzoate in which the phenolic hydrogen has been replaced by a sulfo group.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C10H12O6S
Net Charge
0
Average Mass
260.265
Monoisotopic Mass
260.03546
InChI
InChI=1S/C10H12O6S/c1-2-7-15-10(11)8-3-5-9(6-4-8)16-17(12,13)14/h3-6H,2,7H2,1H3,(H,12,13,14)
InChIKey
WEKBGFBWJOHXKR-UHFFFAOYSA-N
SMILES
O(C(C=1C=CC(=CC1)OS(O)(=O)=O)=O)CCC
ChEBI Ontology
Outgoing
propyl 4-hydroxybenzoate sulfate (
CHEBI:133706
)
has functional parent
4-hydroxybenzoic acid (
CHEBI:30763
)
propyl 4-hydroxybenzoate sulfate (
CHEBI:133706
)
is a
aryl sulfate (
CHEBI:37919
)
propyl 4-hydroxybenzoate sulfate (
CHEBI:133706
)
is a
benzoate ester (
CHEBI:36054
)
propyl 4-hydroxybenzoate sulfate (
CHEBI:133706
)
is conjugate acid of
propyl 4-hydroxybenzoate sulfate(1−) (
CHEBI:133707
)
Incoming
propyl 4-hydroxybenzoate sulfate(1−) (
CHEBI:133707
)
is conjugate base of
propyl 4-hydroxybenzoate sulfate (
CHEBI:133706
)
IUPAC Name
propyl 4-(sulfooxy)benzoate
Synonyms
Sources
propyl 4-sulfooxybenzoate
ChEBI
propyl
p
-hydroxybenzoate sulfate
ChEBI
propyl
para
-hydroxybenzoate sulfate
ChEBI
propyl paraben sulfate
ChEBI
propylparaben sulfate
ChEBI
Last Modified
10 October 2016