| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:50 UTC |
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| Update Date | 2025-03-25 00:53:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200927 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H15NO4 |
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| Molecular Mass | 297.1001 |
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| SMILES | COc1ccc2c(c1)CCn1c-2cc2c(c1=O)COC(=O)C2 |
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| InChI Key | XXPMELNSJJULIB-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 | pyranopyridines |
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| Subclass | pyranopyridines |
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| Direct Parent | pyranopyridines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesalkyl aryl ethersanisolesazacyclic compoundscarbonyl compoundscarboxylic acid estersheteroaromatic compoundshydrocarbon derivativeslactamslactonesmethylpyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridinespyridinonesquinolizines |
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| Substituents | phenol ethercarbonyl groupetherlactampolyhalopyridinealkyl aryl ethercarboxylic acid derivativelactoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinequinolizineazacycleheteroaromatic compoundmethylpyridineoxacyclemonocarboxylic acid or derivativespyridineorganic oxygen compoundanisolecarboxylic acid esterhydrocarbon derivativebenzenoidorganic nitrogen compoundpyranopyridinepyridinoneorganooxygen compound |
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