| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:03:55 UTC |
|---|
| Update Date | 2025-03-21 18:28:23 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00071518 |
|---|
| Frequency | 41.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H12O2 |
|---|
| Molecular Mass | 116.0837 |
|---|
| SMILES | CC1(C)OCCCO1 |
|---|
| InChI Key | RPLSBADGISFNSI-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | ethers |
|---|
| Direct Parent | ketals |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | 1,3-dioxaneshydrocarbon derivativesorganooxygen compoundsoxacyclic compounds |
|---|
| Substituents | oxacycleketalaliphatic heteromonocyclic compoundhydrocarbon derivativemeta-dioxaneorganoheterocyclic compound |
|---|
