| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:35 UTC |
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| Update Date | 2025-03-21 18:36:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00111776 |
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| Frequency | 23.8 |
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| Structure | |
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| Chemical Formula | C8H9N5O2 |
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| Molecular Mass | 207.0756 |
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| SMILES | CC(C(=O)O)n1cnc2c(N)ncnc21 |
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| InChI Key | DNFSDVZNZNHNAB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsmonocarboxylic acids and derivativesn-substituted imidazolesorganic oxidesorganopnictogen compoundsprimary aminespurines and purine derivativespyrimidines and pyrimidine derivatives |
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| Substituents | carbonyl groupcarboxylic acidamino acidalpha-amino acid or derivativesimidazopyrimidinepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundimidolactamorganoheterocyclic compoundazolen-substituted imidazoleazacycleheteroaromatic compoundmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary aminepurineorganic nitrogen compoundamineorganooxygen compound |
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