| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:15 UTC |
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| Update Date | 2025-03-21 18:33:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00096193 |
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| Frequency | 28.8 |
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| Structure | |
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| Chemical Formula | C10H12ClN5O4 |
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| Molecular Mass | 301.0578 |
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| SMILES | Nc1nc2c(ncn2C2OC(CO)C(Cl)C2O)c(=O)[nH]1 |
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| InChI Key | RDEFBJZZNVVKSF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | nucleosides, nucleotides, and analogues |
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| Class | purine nucleosides |
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| Subclass | purine 3'-deoxyribonucleosides |
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| Direct Parent | purine 3'-deoxyribonucleosides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl chloridesazacyclic compoundschlorohydrinsheteroaromatic compoundshydrocarbon derivativeshypoxanthinesimidazoleslactamsn-substituted imidazolesorganic oxidesorganochloridesorganopnictogen compoundsoxacyclic compoundsprimary alcoholsprimary aminespurines and purine derivativespyrimidonessecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | lactamchlorohydrinalkyl chlorideorganochloridepyrimidoneimidazopyrimidineorganohalogen compoundpyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundalkyl halideprimary alcoholorganoheterocyclic compoundazolen-substituted imidazolealcoholvinylogous amideazacycletetrahydrofuranhalohydrinheteroaromatic compoundoxacyclepurine 3'-deoxyribonucleosideorganic oxygen compoundsecondary alcoholhypoxanthinehydrocarbon derivativeprimary aminepurineorganic nitrogen compoundamineorganooxygen compound |
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