| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:54:45 UTC |
|---|
| Update Date | 2025-03-21 18:04:20 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00049915 |
|---|
| Frequency | 66.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C12H16N4O3 |
|---|
| Molecular Mass | 264.1222 |
|---|
| SMILES | O=C1NC(Cc2cnc[nH]2)C(=O)N2CC(O)CCC12 |
|---|
| InChI Key | XDNDBYYZSNGQCE-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | piperazinopiperidines |
|---|
| Subclass | piperazinopiperidines |
|---|
| Direct Parent | piperazinopiperidines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 2,5-dioxopiperazinesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsn-alkylpiperazinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspiperidinessecondary alcoholssecondary carboxylic acid amidestertiary carboxylic acid amides |
|---|
| Substituents | carbonyl grouplactamalpha-amino acid or derivatives2,5-dioxopiperazinecarboxylic acid derivativeorganic oxidedioxopiperazinepiperazinearomatic heteropolycyclic compoundimidazoletertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpiperidinepiperazino-1,2-a-piperidineazolealcoholazacyclen-alkylpiperazineheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compound1,4-diazinanesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
|---|
