Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:15:37 UTC |
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Update Date | 2025-03-21 18:34:11 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00099556 |
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Frequency | 27.6 |
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Structure | |
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Chemical Formula | C9H11N3O3 |
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Molecular Mass | 209.08 |
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SMILES | CN1C(=O)CCC1c1c[nH]c(=O)[nH]c1=O |
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InChI Key | KHHHYQCRVVGZKZ-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 heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsn-alkylpyrrolidinesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolidine-2-onestertiary carboxylic acid amidesvinylogous amides |
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Substituents | 2-pyrrolidonecarbonyl grouplactamaromatic heteromonocyclic compoundpyrimidonecarboxylic acid derivativeorganic oxidetertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundpyrrolidinepyrrolidonevinylogous amidecarbonic acid derivativeazacyclen-alkylpyrrolidineheteroaromatic compoundcarboxamide grouporganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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