| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:57:50 UTC |
|---|
| Update Date | 2025-03-25 00:52:49 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02196232 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H16O3 |
|---|
| Molecular Mass | 172.1099 |
|---|
| SMILES | CC1=CCC(C(C)(C)O)OC1O |
|---|
| InChI Key | IYNAFNVIEUDSTK-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrans |
|---|
| Subclass | pyrans |
|---|
| Direct Parent | pyrans |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | hemiacetalshydrocarbon derivativesoxacyclic compoundstertiary alcohols |
|---|
| Substituents | alcoholoxacycletertiary alcoholorganic oxygen compoundpyranaliphatic heteromonocyclic compoundhemiacetalhydrocarbon derivativeorganooxygen compound |
|---|
