| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:01:09 UTC |
|---|
| Update Date | 2025-03-25 00:54:04 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02203892 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C16H28O15 |
|---|
| Molecular Mass | 460.1428 |
|---|
| SMILES | OCC1OC(OC2(OC3COC(O)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O |
|---|
| InChI Key | NLZYTPXIVBIZCR-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | orthocarboxylic acid derivatives |
|---|
| Subclass | carboxylic acid orthoesters |
|---|
| Direct Parent | carboxylic acid orthoesters |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | acetalshemiacetalshydrocarbon derivativesmonosaccharidesortho estersoxacyclic compoundsoxanesprimary alcoholssecondary alcoholstetrahydrofurans |
|---|
| Substituents | alcoholortho estertetrahydrofuranmonosaccharidecarboxylic acid orthoesteroxacyclesaccharideorganic oxygen compoundacetalaliphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeoxaneprimary alcoholorganoheterocyclic compoundorganooxygen compound |
|---|