| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:54:27 UTC |
|---|
| Update Date | 2025-03-21 18:53:11 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00191502 |
|---|
| Frequency | 11.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H16O |
|---|
| Molecular Mass | 140.1201 |
|---|
| SMILES | CC1=C(CC(C)O)CCC1 |
|---|
| InChI Key | KUPJHXJCMFBQHD-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 homomonocyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivatives |
|---|
| Substituents | secondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivative |
|---|
