| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:03:29 UTC |
|---|
| Update Date | 2025-03-25 00:54:54 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02209276 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C13H18N5O7P |
|---|
| Molecular Mass | 387.0944 |
|---|
| SMILES | CC1(C)OC2C(O)C(n3cnc4c(N)ncnc43)C(OP(=O)(O)O)C2O1 |
|---|
| InChI Key | NVBKMSYIJJTUJP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | imidazopyrimidines |
|---|
| Subclass | purines and purine derivatives |
|---|
| Direct Parent | purines and purine derivatives |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1,3-dioxolanesazacyclic compoundscyclic alcohols and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsketalsmonoalkyl phosphatesn-substituted imidazolesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary aminespyrimidines and pyrimidine derivativessecondary alcohols |
|---|
| Substituents | meta-dioxolanepyrimidineorganic oxideacetalaromatic heteropolycyclic compoundimidazoleketalorganonitrogen compoundorganopnictogen compoundimidolactamazolen-substituted imidazolealcoholazacycleheteroaromatic compoundcyclic alcoholoxacycleorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary aminepurineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
|---|
