| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:44:57 UTC |
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| Update Date | 2025-03-21 18:00:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00026559 |
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| Frequency | 150.7 |
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| Structure | |
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| Chemical Formula | C8H11NO6 |
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| Molecular Mass | 217.0586 |
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| SMILES | CC(=O)NC(CCC(=O)C(=O)O)C(=O)O |
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| InChI Key | MTAAMGVSCWRCKV-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 | n-acyl-alpha amino acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetamidesalpha amino acidsalpha-hydroxy ketonesalpha-keto acids and derivativesamino fatty acidscarboxylic acidsdicarboxylic acids and derivativesfatty acylshydrocarbon derivativesmedium-chain keto acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidalpha-hydroxy ketoneketoneorganic oxideorganonitrogen compoundalpha-keto acidalpha-amino acidorganopnictogen compoundacetamiden-acyl-alpha-amino acidcarboxamide groupamino fatty acidsecondary carboxylic acid amideorganic oxygen compoundketo aciddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundmedium-chain keto acid |
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