| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:18:22 UTC |
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| Update Date | 2025-03-21 23:13:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00670481 |
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| Frequency | 2.3 |
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| Structure | |
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| Chemical Formula | C4H3NO3 |
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| Molecular Mass | 113.0113 |
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| SMILES | N#CC(=O)CC(=O)O |
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| InChI Key | RGPSXEGIFWXCDR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | keto acids and derivatives |
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| Subclass | short-chain keto acids and derivatives |
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| Direct Parent | short-chain keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acyl cyanidesbeta-hydroxy ketonesbeta-keto acids and derivativescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | beta-hydroxy ketonealiphatic acyclic compoundcarbonyl groupnitrilecarboxylic acidshort-chain keto acidcarboxylic acid derivativebeta-keto acidketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundacyl cyanideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrileorganooxygen compound |
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