| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:50 UTC |
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| Update Date | 2025-03-25 00:47:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02164314 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H14N4O4 |
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| Molecular Mass | 254.1015 |
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| SMILES | CC(O)C(O)C1=NC(c2c[nH]c(=O)[nH]c2=O)NC1 |
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| InChI Key | WTIATRBQTQIWMY-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 | 1,2-diolsazacyclic compoundsdialkylaminesheteroaromatic compoundshydrocarbon derivativesimidazolinesketimineslactamsorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary alcoholsvinylogous amides |
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| Substituents | ketiminelactamaromatic heteromonocyclic compoundiminepyrimidonepropargyl-type 1,3-dipolar organic compoundorganic oxideorganonitrogen compoundorganopnictogen compound1,2-diolalcoholvinylogous amidesecondary aliphatic aminecarbonic acid derivativeazacycleheteroaromatic compoundorganic 1,3-dipolar compoundsecondary amineorganic oxygen compoundimidazolinesecondary alcohol3-imidazolinehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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