| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:41:44 UTC |
|---|
| Update Date | 2025-03-25 00:47:08 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02159616 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C11H9NO3 |
|---|
| Molecular Mass | 203.0582 |
|---|
| SMILES | O=CCc1c[nH]c2ccc(O)cc(=O)c12 |
|---|
| InChI Key | LKZRLXOKCOZDQX-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | hydrocarbon derivatives |
|---|
| Class | tropones |
|---|
| Subclass | tropones |
|---|
| Direct Parent | tropones |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | alpha-hydrogen aldehydesazacyclic compoundsheteroaromatic compoundsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolesvinylogous acidsvinylogous amides |
|---|
| Substituents | vinylogous amidecarbonyl grouptroponeazacycleheteroaromatic compoundaldehydevinylogous acidorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundalpha-hydrogen aldehydepyrroleorganonitrogen compoundorganopnictogen compoundorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
|---|
