| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:21:04 UTC |
|---|
| Update Date | 2025-03-25 01:01:28 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02249563 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C20H28O3 |
|---|
| Molecular Mass | 316.2038 |
|---|
| SMILES | Cc1c2c(cc3c1C(C)CCC3C)OC(C)(CCC(=O)O)CC2 |
|---|
| InChI Key | XYHFLFXNLFHQRN-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | naphthopyrans |
|---|
| Subclass | naphthopyrans |
|---|
| Direct Parent | naphthopyrans |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1-benzopyransalkyl aryl etherscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesnaphthalenesorganic oxidesoxacyclic compoundspyranstetralins |
|---|
| Substituents | tetralincarbonyl groupetherbenzopyrancarboxylic acid1-benzopyranalkyl aryl ethercarboxylic acid derivativeoxacyclenaphthopyranorganic oxidemonocarboxylic acid or derivativesnaphthaleneorganic oxygen compoundaromatic heteropolycyclic compoundpyranchromanehydrocarbon derivativebenzenoidorganooxygen compound |
|---|