| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:28 UTC |
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| Update Date | 2025-03-25 01:00:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02241171 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H23NO5 |
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| Molecular Mass | 321.1576 |
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| SMILES | CC(=O)NCCCC(=O)OC(=O)CCC(O)Cc1ccccc1 |
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| InChI Key | RGQJTDKVYBBNIJ-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 | gamma amino acids and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acetamidesbenzene and substituted derivativescarbonyl compoundscarboxylic acid anhydridesdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary alcoholssecondary carboxylic acid amides |
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| Substituents | alcoholmonocyclic benzene moietycarbonyl groupgamma amino acid or derivativescarboxamide grouparomatic homomonocyclic compoundsecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganonitrogen compoundcarboxylic acid anhydridesecondary alcoholdicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundacetamideorganooxygen compound |
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