| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:37:06 UTC |
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| Update Date | 2025-03-21 17:57:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00008697 |
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| Frequency | 728.5 |
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| Structure | |
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| Chemical Formula | C7H13NO4 |
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| Molecular Mass | 175.0845 |
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| SMILES | CC(C)C(=O)NC(CO)C(=O)O |
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| InChI Key | QSEFPFCSTSMYJB-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 | alpha amino acidsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary alcoholssecondary carboxylic acid amidesserine and derivatives |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupcarboxylic acidn-acyl-alpha-amino acidhydroxy acidcarboxamide groupsecondary carboxylic acid amidebeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholserine or derivativesorganooxygen compound |
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