| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:14 UTC |
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| Update Date | 2025-03-25 00:59:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02238344 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H8N2O3 |
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| Molecular Mass | 168.0535 |
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| SMILES | O=C(O)C1=NC2CCC1C(=O)N2 |
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| InChI Key | QQHVDNBEZGLYIP-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 | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidones |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsdelta lactamshydrocarbon derivativeshydropyrimidinesketiminesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspiperidinonespropargyl-type 1,3-dipolar organic compoundssecondary carboxylic acid amidestetrahydropyridines |
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| Substituents | ketiminecarbonyl grouplactamcarboxylic acidiminepyrimidonecarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundaliphatic heteropolycyclic compoundorganic oxideorganonitrogen compoundhydropyrimidineorganopnictogen compoundpiperidinonepiperidine1,2,5,6-tetrahydropyrimidineazacycletetrahydropyridineorganic 1,3-dipolar compoundcarboxamide groupdelta-lactamsecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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