Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 01:10:15 UTC |
---|
Update Date | 2025-03-21 19:05:44 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00227889 |
---|
Frequency | 9.4 |
---|
Structure | |
---|
Chemical Formula | C4H7NO3 |
---|
Molecular Mass | 117.0426 |
---|
SMILES | NC1COC(=O)C1O |
---|
InChI Key | QTHZCXKBPFFRQD-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | organoheterocyclic compounds |
---|
Class | lactones |
---|
Subclass | gamma butyrolactones |
---|
Direct Parent | gamma butyrolactones |
---|
Geometric Descriptor | aliphatic heteromonocyclic compounds |
---|
Alternative Parents | carbonyl compoundscarboxylic acid estershydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundssecondary alcoholstetrahydrofurans |
---|
Substituents | alcoholcarbonyl grouptetrahydrofuranmonosaccharidecarboxylic acid derivativegamma butyrolactoneoxacyclesaccharideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
---|