Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 00:30:38 UTC |
---|
Update Date | 2025-03-21 18:41:40 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00135483 |
---|
Frequency | 18.5 |
---|
Structure | |
---|
Chemical Formula | C17H24O11 |
---|
Molecular Mass | 404.1319 |
---|
SMILES | COc1cc(CC(O)COC2OC(C(=O)O)C(O)C(O)C2O)cc(OC)c1O |
---|
InChI Key | SKFOAOLMRFVAME-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | lipids and lipid-like molecules |
---|
Class | fatty acyls |
---|
Subclass | fatty acyl glycosides |
---|
Direct Parent | fatty acyl glycosides of mono- and disaccharides |
---|
Geometric Descriptor | aromatic heteromonocyclic compounds |
---|
Alternative Parents | acetalsalkyl aryl ethersalkyl glycosidesanisolesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdimethoxybenzenesglucuronic acid derivativeshydrocarbon derivativesmethoxyphenolsmonocarboxylic acids and derivativesmonosaccharideso-glucuronidesorganic oxidesoxacyclic compoundsoxanesphenoxy compoundspyran carboxylic acidssecondary alcohols |
---|
Substituents | fatty acyl glycoside of mono- or disaccharidephenol ethermonocyclic benzene moietycarbonyl groupethercarboxylic acidglucuronic acid or derivativesaromatic heteromonocyclic compoundo-glucuronidemethoxyphenolmonosaccharidealkyl aryl ethercarboxylic acid derivativepyran carboxylic acid1-o-glucuronidedimethoxybenzenebeta-hydroxy acidsaccharideorganic oxideacetaloxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativeshydroxy acidmethoxybenzeneoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundm-dimethoxybenzenepyrananisolesecondary alcoholphenolhydrocarbon derivativebenzenoidphenoxy compoundorganooxygen compoundalkyl glycoside |
---|