| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:50:41 UTC |
|---|
| Update Date | 2025-03-21 18:51:50 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00182910 |
|---|
| Frequency | 20.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H5N5 |
|---|
| Molecular Mass | 135.0545 |
|---|
| SMILES | Nc1ncc2cn[nH]c2n1 |
|---|
| InChI Key | SMXRCJBCWRHDJE-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrazolopyrimidines |
|---|
| Subclass | pyrazolo[3,4-d]pyrimidines |
|---|
| Direct Parent | pyrazolo[3,4-d]pyrimidines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganopnictogen compoundsprimary aminespyrazolespyrimidines and pyrimidine derivatives |
|---|
| Substituents | pyrazolo[3,4-d]pyrimidineazacycleheteroaromatic compoundpyrazolepyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineazole |
|---|
