| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:07:59 UTC |
|---|
| Update Date | 2025-03-21 18:30:11 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00081380 |
|---|
| Frequency | 35.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C20H16O7 |
|---|
| Molecular Mass | 368.0896 |
|---|
| SMILES | O=C1OCC2C(O)c3cc4c(cc3C(c3ccc5c(c3)OCO5)C12)OCO4 |
|---|
| InChI Key | YHJFTFBBJVFCBI-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | lignans, neolignans and related compounds |
|---|
| Class | lignan lactones |
|---|
| Subclass | lignan lactones |
|---|
| Direct Parent | lignan lactones |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | acetalsaryltetralin lignansbenzodioxolescarbonyl compoundscarboxylic acid estersfuranonaphthodioxolesgamma butyrolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundssecondary alcoholstetrahydrofuranstetralins |
|---|
| Substituents | linear furanonaphthodioxoletetralincarbonyl group1-aryltetralin lignancarboxylic acid derivativelignan lactonelactoneorganic oxideacetalaromatic heteropolycyclic compoundorganoheterocyclic compoundbenzodioxolealcoholnaphthofurantetrahydrofurangamma butyrolactoneoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativebenzenoidorganooxygen compound |
|---|
