| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:31:26 UTC |
|---|
| Update Date | 2025-03-21 18:42:01 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00137341 |
|---|
| Frequency | 18.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H14O5 |
|---|
| Molecular Mass | 190.0841 |
|---|
| SMILES | OCC(O)C1(O)C=CC(O)C(O)C1 |
|---|
| InChI Key | FWSOEKHVUSXEIZ-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | alcohols and polyols |
|---|
| Direct Parent | cyclitols and derivatives |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivativesprimary alcoholssecondary alcoholstertiary alcohols |
|---|
| Substituents | tertiary alcoholsecondary alcoholaliphatic homomonocyclic compoundcyclitol or derivativeshydrocarbon derivativeprimary alcohol |
|---|
