Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-20 23:47:11 UTC |
---|
Update Date | 2025-03-21 18:01:15 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00031788 |
---|
Frequency | 115.4 |
---|
Structure | |
---|
Chemical Formula | C5H6O5S |
---|
Molecular Mass | 177.9936 |
---|
SMILES | Cc1ccc(OS(=O)(=O)O)o1 |
---|
InChI Key | DYLGWOWSNPYYKC-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | organic acids and derivatives |
---|
Class | organic sulfuric acids and derivatives |
---|
Subclass | arylsulfates |
---|
Direct Parent | arylsulfates |
---|
Geometric Descriptor | aromatic heteromonocyclic compounds |
---|
Alternative Parents | furansheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsoxacyclic compoundssulfuric acid monoesters |
---|
Substituents | furansulfuric acid monoesteraromatic heteromonocyclic compoundheteroaromatic compoundoxacycleorganic oxideorganic oxygen compoundsulfate-esterhydrocarbon derivativearylsulfatesulfuric acid esterorganoheterocyclic compoundorganooxygen compound |
---|