Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 14:55:04 UTC |
---|
Update Date | 2025-03-25 00:51:53 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID02190069 |
---|
Frequency | 0.5 |
---|
Structure | |
---|
Chemical Formula | C9H14O2 |
---|
Molecular Mass | 154.0994 |
---|
SMILES | C=CCC(OC(C)=O)C(=C)C |
---|
InChI Key | LWWNVGSVNDHBKZ-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | organic acids and derivatives |
---|
Class | carboxylic acids and derivatives |
---|
Subclass | carboxylic acid derivatives |
---|
Direct Parent | carboxylic acid esters |
---|
Geometric Descriptor | aliphatic acyclic compounds |
---|
Alternative Parents | carbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
---|
Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
---|