| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:38:52 UTC |
|---|
| Update Date | 2025-03-25 00:46:05 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02153180 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H10N6O2 |
|---|
| Molecular Mass | 222.0865 |
|---|
| SMILES | NC(=O)C1=CNc2c([nH]c(N)nc2=O)NC1 |
|---|
| InChI Key | DZIXOMDYHBRBHH-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrimidodiazepines |
|---|
| Subclass | pyrimidodiazepines |
|---|
| Direct Parent | pyrimidodiazepines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1,4-diazepinesamino acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary aminesprimary carboxylic acid amidespyrimidonessecondary alkylarylaminesvinylogous amides |
|---|
| Substituents | primary carboxylic acid amidecarbonyl groupamino acid or derivativespyrimidonecarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpyrimidodiazepinevinylogous amideazacycleheteroaromatic compoundsecondary aminecarboxamide groupsecondary aliphatic/aromatic aminepara-diazepineorganic oxygen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
|---|
