| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:43:31 UTC |
|---|
| Update Date | 2025-03-25 00:47:43 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02163623 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C22H38O6 |
|---|
| Molecular Mass | 398.2668 |
|---|
| SMILES | CC12CCC(O)CC1CC(O)C1CC3CCC(O)(C(O)CO)C3(C)CC(O)C12 |
|---|
| InChI Key | QQQRCGAMRKHJSV-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | alcohols and polyols |
|---|
| Direct Parent | tertiary alcohols |
|---|
| Geometric Descriptor | aliphatic homopolycyclic compounds |
|---|
| Alternative Parents | cyclic alcohols and derivativeshydrocarbon derivativesprimary alcoholssecondary alcohols |
|---|
| Substituents | tertiary alcoholsecondary alcoholhydrocarbon derivativecyclic alcoholprimary alcoholaliphatic homopolycyclic compound |
|---|
