| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:27:12 UTC |
|---|
| Update Date | 2025-03-21 18:39:51 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00127508 |
|---|
| Frequency | 20.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H8N4O |
|---|
| Molecular Mass | 176.0698 |
|---|
| SMILES | COc1cnc2ncnc(N)c2c1 |
|---|
| InChI Key | ILQPNLCKSLBHSH-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyridopyrimidines |
|---|
| Subclass | pyrido[2,3-d]pyrimidines |
|---|
| Direct Parent | pyrido[2,3-d]pyrimidines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 2-halopyridinesalkyl aryl ethersazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmethylpyridinesorganopnictogen compoundspolyhalopyridinesprimary aminespyrimidines and pyrimidine derivatives |
|---|
| Substituents | etherazacyclepolyhalopyridineheteroaromatic compoundmethylpyridinealkyl aryl etherpyrimidinepyridineorganic oxygen compoundpyrido[2,3-d]pyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amine2-halopyridineorganic nitrogen compoundimidolactamamineorganooxygen compound |
|---|
