Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 00:28:08 UTC |
---|
Update Date | 2025-03-21 18:40:21 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00129740 |
---|
Frequency | 19.6 |
---|
Structure | |
---|
Chemical Formula | C16H24N2O12 |
---|
Molecular Mass | 436.1329 |
---|
SMILES | O=c1ccn(C2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1 |
---|
InChI Key | GFJDBPZETFXEGI-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | organoheterocyclic compounds |
---|
Class | diazines |
---|
Subclass | pyrimidines and pyrimidine derivatives |
---|
Direct Parent | pyrimidones |
---|
Geometric Descriptor | aromatic heteromonocyclic compounds |
---|
Alternative Parents | acetalsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcoholsvinylogous amides |
---|
Substituents | lactamaromatic heteromonocyclic compoundmonosaccharidepyrimidonesaccharideorganic oxideacetalorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholalcoholvinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
---|