| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:45 UTC |
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| Update Date | 2025-03-25 00:47:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02164154 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H18N2O3 |
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| Molecular Mass | 286.1317 |
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| SMILES | CC1=C(CCC(=O)O)C(=Nc2c(C)cccc2C)NC1=O |
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| InChI Key | KBAPRHKTDNCKIB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | xylenes |
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| Direct Parent | m-xylenes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrrolines |
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| Substituents | carbonyl groupcarboxylic acidaromatic heteromonocyclic compoundazacyclem-xyleneorganic 1,3-dipolar compoundcarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundpyrrolineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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