| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:26 UTC |
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| Update Date | 2025-03-21 18:06:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00065568 |
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| Frequency | 46.7 |
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| Structure | |
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| Chemical Formula | C9H14N2O7 |
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| Molecular Mass | 262.0801 |
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| SMILES | O=C1CCN(C2OOC(CO)C(O)C2O)C(=O)N1 |
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| InChI Key | WCRFLWIVQAJQAN-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 heteromonocyclic compounds |
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| Alternative Parents | 1,2-dioxanesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkyl peroxidesdiazinanesdicarboximideshydrocarbon derivativesn-acyl ureasorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcohols |
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| Substituents | carbonyl grouppyrimidonecarboxylic acid derivative1,3-diazinaneorganic oxidedialkyl peroxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compounddicarboximideprimary alcoholureidealcoholn-acyl ureacarbonic acid derivativeazacycleoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundortho-dioxaneorganooxygen compound |
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