Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 14:39:07 UTC |
---|
Update Date | 2025-03-25 00:46:11 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID02153763 |
---|
Frequency | 0.5 |
---|
Structure | |
---|
Chemical Formula | C13H18O3 |
---|
Molecular Mass | 222.1256 |
---|
SMILES | CC(=O)CCC(O)C(O)Cc1ccccc1 |
---|
InChI Key | UONXWVDTDGKTQD-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | lipids and lipid-like molecules |
---|
Class | fatty acyls |
---|
Subclass | fatty alcohols |
---|
Direct Parent | fatty alcohols |
---|
Geometric Descriptor | aromatic homomonocyclic compounds |
---|
Alternative Parents | 1,2-diolsbenzene and substituted derivativeshydrocarbon derivativesketonesorganic oxidessecondary alcohols |
---|
Substituents | alcoholmonocyclic benzene moietycarbonyl groupketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundfatty alcoholsecondary alcoholhydrocarbon derivativebenzenoidorganooxygen compound1,2-diol |
---|