CHEBI:133529 - dopamine 4-O-sulfate zwitterion

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name dopamine 4-O-sulfate zwitterion
ChEBI ID CHEBI:133529
ChEBI ASCII Name dopamine 4-O-sulfate zwitterion
Definition A zwitterion obtained by transfer of a proton from the sulfonyl to the amino group of dopamine 4-O-sulfate; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C8H11NO5S
Net Charge 0
Average Mass 233.243
Monoisotopic Mass 233.03579
InChI InChI=1S/C8H11NO5S/c9-4-3-6-1-2-8(7(10)5-6)14-15(11,12)13/h1-2,5,10H,3-4,9H2,(H,11,12,13)
InChIKey DEKNNWJXAQTLFA-UHFFFAOYSA-N
SMILES C=1(C(=CC(=CC1)CC[NH3+])O)OS([O-])(=O)=O
Roles Classification
Biological Role(s): human blood serum metabolite
Any metabolite (endogenous or exogenous) found in human blood serum samples.
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing dopamine 4-O-sulfate zwitterion (CHEBI:133529) has role human blood serum metabolite (CHEBI:85234)
dopamine 4-O-sulfate zwitterion (CHEBI:133529) has role human urinary metabolite (CHEBI:84087)
dopamine 4-O-sulfate zwitterion (CHEBI:133529) is a zwitterion (CHEBI:27369)
dopamine 4-O-sulfate zwitterion (CHEBI:133529) is tautomer of dopamine 4-O-sulfate (CHEBI:34729)
Incoming dopamine 4-O-sulfate (CHEBI:34729) is tautomer of dopamine 4-O-sulfate zwitterion (CHEBI:133529)
IUPAC Name
4-(2-azaniumylethyl)-2-hydroxyphenyl sulfate
Synonyms Sources
dopamine 4-monosulfate zwitterion ChEBI
dopamine 4-sulfate zwitterion ChEBI
Last Modified
30 September 2016