Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 00:31:09 UTC |
---|
Update Date | 2025-03-21 18:41:53 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00136662 |
---|
Frequency | 18.3 |
---|
Structure | |
---|
Chemical Formula | C8H14O7 |
---|
Molecular Mass | 222.074 |
---|
SMILES | O=C1OC(C(O)CO)C(O)C(O)C1CO |
---|
InChI Key | KGTWYDMCSJHAIY-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | organoheterocyclic compounds |
---|
Class | lactones |
---|
Subclass | delta valerolactones |
---|
Direct Parent | delta valerolactones |
---|
Geometric Descriptor | aliphatic heteromonocyclic compounds |
---|
Alternative Parents | carbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesprimary alcoholssecondary alcohols |
---|
Substituents | alcoholcarbonyl groupdelta valerolactonemonosaccharidecarboxylic acid derivativeoxacyclesaccharideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeoxaneprimary alcoholdelta_valerolactoneorganooxygen compound |
---|