| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:04:34 UTC |
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| Update Date | 2025-03-21 18:28:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00073115 |
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| Frequency | 40.8 |
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| Structure | |
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| Chemical Formula | C5H7NO4 |
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| Molecular Mass | 145.0375 |
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| SMILES | NC(=CC(=O)O)CC(=O)O |
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| InChI Key | RFKFGKSLNIJSQT-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 | carboxylic acids and derivatives |
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| Subclass | dicarboxylic acids and derivatives |
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| Direct Parent | dicarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsunsaturated fatty acidsvinylogous amides |
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| Substituents | fatty acylvinylogous amidealiphatic acyclic compoundcarbonyl groupcarboxylic acidfatty acidunsaturated fatty acidorganic oxideorganic oxygen compoundorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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