Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-20 23:46:40 UTC |
---|
Update Date | 2025-03-21 18:01:02 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00030522 |
---|
Frequency | 121.8 |
---|
Structure | |
---|
Chemical Formula | C12H20O11 |
---|
Molecular Mass | 340.1006 |
---|
SMILES | CC1OC(OC(C(O)C=O)C(O)C(O)C(=O)O)C(O)C(O)C1O |
---|
InChI Key | VKZVIBLVTJJFOM-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | organic oxygen compounds |
---|
Class | organooxygen compounds |
---|
Subclass | carbohydrates and carbohydrate conjugates |
---|
Direct Parent | glucuronic acid derivatives |
---|
Geometric Descriptor | aliphatic heteromonocyclic compounds |
---|
Alternative Parents | acetalsalpha hydroxy acids and derivativesalpha-hydroxyaldehydesbeta hydroxy acids and derivativescarboxylic acidsheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanessecondary alcohols |
---|
Substituents | fatty acylcarbonyl groupcarboxylic acidglucuronic acid or derivativesheterocyclic fatty acidalpha-hydroxy acidmonosaccharidefatty acidcarboxylic acid derivativemedium-chain hydroxy acidbeta-hydroxy acidorganic oxidealpha-hydroxyaldehydeacetalaliphatic heteromonocyclic compoundmedium-chain fatty acidhydroxy fatty acidoxaneorganoheterocyclic compoundalcoholaldehydehydroxy acidoxacyclemonocarboxylic acid or derivativessecondary alcoholhydrocarbon derivative |
---|