| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 02:35:28 UTC |
|---|
| Update Date | 2025-03-21 21:52:37 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00427450 |
|---|
| Frequency | 4.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H12O |
|---|
| Molecular Mass | 112.0888 |
|---|
| SMILES | C=CC(C=C)C(C)O |
|---|
| InChI Key | HDZUGBDDJQMLBW-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | alcohols and polyols |
|---|
| Direct Parent | secondary alcohols |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivatives |
|---|
| Substituents | aliphatic acyclic compoundsecondary alcoholhydrocarbon derivative |
|---|
