Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 00:23:28 UTC |
---|
Update Date | 2025-03-21 18:38:04 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00118774 |
---|
Frequency | 22.0 |
---|
Structure | |
---|
Chemical Formula | C10H14O3 |
---|
Molecular Mass | 182.0943 |
---|
SMILES | CC(O)(CO)Cc1ccc(O)cc1 |
---|
InChI Key | RBRMFXSOQHZOAW-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | benzenoids |
---|
Class | benzene and substituted derivatives |
---|
Subclass | phenylpropanes |
---|
Direct Parent | phenylpropanes |
---|
Geometric Descriptor | aromatic homomonocyclic compounds |
---|
Alternative Parents | 1,2-diols1-hydroxy-2-unsubstituted benzenoidshydrocarbon derivativestertiary alcohols |
---|
Substituents | alcohol1-hydroxy-2-unsubstituted benzenoidphenylpropanearomatic homomonocyclic compoundtertiary alcoholorganic oxygen compoundphenolhydrocarbon derivativeorganooxygen compound1,2-diol |
---|