| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:11:28 UTC |
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| Update Date | 2025-03-25 00:57:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02227633 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H9NO5 |
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| Molecular Mass | 187.0481 |
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| SMILES | CC(=O)NC(CC(=O)O)C(=O)C=O |
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| InChI Key | NNZBWUGTPGMIHH-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 | amino acids, peptides, and analogues |
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| Direct Parent | beta amino acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetamidesalpha ketoaldehydescarboxylic acidsgamma-keto acids and derivativeshydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidesshort-chain keto acids and derivatives |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain keto acidaldehydecarboxamide groupbeta amino acid or derivativesgamma-keto acidketonesecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundketo acidorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundalpha-ketoaldehydeacetamideorganooxygen compound |
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