| Record Information |
|---|
| HMDB Status | quantified |
|---|
| Creation Date | 2024-02-20 23:34:41 UTC |
|---|
| Update Date | 2025-03-21 17:56:42 UTC |
|---|
| HMDB ID | HMDB0000863 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00003078 |
|---|
| Name | Isopropyl alcohol |
|---|
| Frequency | 1923.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C3H8O |
|---|
| Molecular Mass | 60.0575 |
|---|
| SMILES | CC(C)O |
|---|
| InChI Key | KFZMGEQAYNKOFK-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 |
|---|
