| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:02:07 UTC |
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| Update Date | 2025-03-21 18:07:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00067201 |
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| Frequency | 57.5 |
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| Structure | |
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| Chemical Formula | C10H12N4O5 |
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| Molecular Mass | 268.0808 |
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| SMILES | O=c1[nH]c(=O)c2cnn(C3CC(O)C(CO)O3)c2[nH]1 |
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| InChI Key | UCWVZJPSZVFVJG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | imidazopyrimidines |
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| Subclass | purines and purine derivatives |
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| Direct Parent | xanthines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkaloids and derivativesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholspyrazolespyrazolo[3,4-d]pyrimidinespyrimidonessecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | lactammonosaccharidepyrimidonepyrazolepyrimidinesaccharideorganic oxidepyrazolopyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundprimary alcoholazolepyrazolo[3,4-d]pyrimidinealcoholvinylogous amidecarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundxanthineoxacyclealkaloid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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