| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:09 UTC |
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| Update Date | 2025-03-25 00:53:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201596 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H25NO7 |
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| Molecular Mass | 403.1631 |
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| SMILES | Cc1c(CCC(=O)O)c(C)c2c(C)c(CCC(=O)O)c(=O)[nH]c2c1CCC(=O)O |
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| InChI Key | FZPNFGKNSABAAT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | quinolines and derivatives |
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| Subclass | quinolones and derivatives |
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| Direct Parent | hydroquinolones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroxypyridineslactamsmethylpyridinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyridinonestricarboxylic acids and derivatives |
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| Substituents | carbonyl grouplactamcarboxylic acidpolyhalopyridinetricarboxylic acid or derivativescarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineazacycleheteroaromatic compoundhydroxypyridinedihydroquinolinemethylpyridinedihydroquinolonepyridineorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneorganooxygen compound |
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