| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:32:20 UTC |
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| Update Date | 2025-03-21 18:42:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00139411 |
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| Frequency | 26.7 |
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| Structure | |
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| Chemical Formula | C9H12N4O4 |
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| Molecular Mass | 240.0859 |
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| SMILES | CC(O)C(=O)C1CNc2[nH]c(=O)[nH]c(=O)c2N1 |
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| InChI Key | XORXSXDYWBMYCD-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 | aromatic heteropolycyclic compounds |
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| Alternative Parents | acyloinsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesketoneslactamsorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundssecondary alcoholssecondary alkylarylaminesvinylogous amides |
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| Substituents | carbonyl grouplactampyrimidoneketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundalcoholvinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundsecondary aminesecondary aliphatic/aromatic amineorganic oxygen compoundacyloinsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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