| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:27 UTC |
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| Update Date | 2025-03-25 00:52:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02190896 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C23H22N2O6 |
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| Molecular Mass | 422.1478 |
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| SMILES | C=CC1=C(C)C(=O)NC1=Cc1[nH]c(C=C2C(=O)C(=O)C(O)=C2C)c(CCC(=O)O)c1C |
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| InChI Key | KEJYSLSESJIMTL-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 | heteroaromatic compounds |
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| Subclass | heteroaromatic compounds |
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| Direct Parent | heteroaromatic compounds |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acidscyclic ketoneshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolespyrrolinessecondary carboxylic acid amides |
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| Substituents | carbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundcyclic ketonecarboxamide groupcarboxylic acid derivativeketonesecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundpyrrolinepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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