| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:22 UTC |
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| Update Date | 2025-03-25 00:55:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02211430 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H19N2O3+ |
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| Molecular Mass | 203.139 |
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| SMILES | CC(=O)NCCOC(=O)C[N+](C)(C)C |
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| InChI Key | VSFDMDIILXZVCI-UHFFFAOYSA-O |
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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 | alpha amino acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetamidesalpha amino acidsaminescarbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundssecondary carboxylic acid amidestetraalkylammonium salts |
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| Substituents | aliphatic acyclic compoundcarbonyl grouptetraalkylammonium saltalpha-amino acid esterquaternary ammonium saltcarboxamide groupsecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic saltamineacetamideorganooxygen compound |
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