| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:14:43 UTC |
|---|
| Update Date | 2025-03-21 18:33:44 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00097357 |
|---|
| Frequency | 28.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C4H7NO4 |
|---|
| Molecular Mass | 133.0375 |
|---|
| SMILES | O=NOCCCC(=O)O |
|---|
| InChI Key | HDCVEIALPFSRHP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | hydroxy acids and derivatives |
|---|
| Subclass | short-chain hydroxy acids and derivatives |
|---|
| Direct Parent | short-chain hydroxy acids and derivatives |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alkyl nitritescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesnitrite estersorganic o-nitroso compoundsorganic nitrogen compoundsorganic oxidesstraight chain fatty acids |
|---|
| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupstraight chain fatty acidorganic nitroso compoundcarboxylic acidshort-chain hydroxy acidfatty acidcarboxylic acid derivativeorganic nitritealkyl nitriteorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativenitrite esterorganic nitrogen compoundorganooxygen compoundorganic o-nitroso compound |
|---|
