| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:06 UTC |
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| Update Date | 2025-03-21 18:33:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00098303 |
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| Frequency | 28.0 |
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| Structure | |
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| Chemical Formula | C9H16NO6+ |
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| Molecular Mass | 234.0972 |
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| SMILES | C[N+](C)(C)CC(=O)OC(CC(=O)O)C(=O)O |
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| InChI Key | ZPCKCDHNWPTYTD-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 | peptidomimetics |
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| Subclass | depsipeptides |
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| Direct Parent | depsipeptides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acid estersalpha amino acidsaminescarbonyl compoundscarboxylic acid esterscarboxylic acidshydrocarbon derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium saltstricarboxylic acids and derivatives |
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| Substituents | aliphatic acyclic compounddepsipeptidecarbonyl groupcarboxylic acidtetraalkylammonium saltalpha-amino acid esterquaternary ammonium salttricarboxylic acid or derivativesalpha-amino acid or derivativescarboxylic acid derivativeorganic oxideorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
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