| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 01:34:46 UTC |
|---|
| Update Date | 2025-03-21 19:58:11 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00284856 |
|---|
| Frequency | 7.1 |
|---|
| Structure | |
|---|
| Chemical Formula | C4H10N2O3 |
|---|
| Molecular Mass | 134.0691 |
|---|
| SMILES | CN(C)CCO[N+](=O)[O-] |
|---|
| InChI Key | GJDARAQHIZQIDM-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | organic nitric acids and derivatives |
|---|
| Subclass | nitrate esters |
|---|
| Direct Parent | nitrate esters |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alkyl nitrateshydrocarbon derivativesorganic nitro compoundsorganic oxidesorganooxygen compoundsorganopnictogen compoundstrialkylamines |
|---|
| Substituents | aliphatic acyclic compoundorganic nitratenitrate esterallyl-type 1,3-dipolar organic compoundtertiary aliphatic amineorganic 1,3-dipolar compoundorganic nitro compoundorganic oxideorganic oxygen compoundalkyl nitrateorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundaminetertiary amineorganooxygen compoundorganic hyponitrite |
|---|
