| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:59 UTC |
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| Update Date | 2025-03-25 00:51:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02187605 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H19NO2 |
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| Molecular Mass | 245.1416 |
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| SMILES | CC(C)(C)c1ccc(C(=O)C2CCC(O)=N2)cc1 |
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| InChI Key | MIEXOMLXKXUWIT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | alkyl-phenylketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl alkyl ketonesazacyclic compoundsbenzoyl derivativescyclic carboximidic acidshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsphenylpropanespropargyl-type 1,3-dipolar organic compoundspyrroline carboxylic acids and derivatives |
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| Substituents | monocyclic benzene moietyaryl alkyl ketonearomatic heteromonocyclic compoundbenzoylpropargyl-type 1,3-dipolar organic compoundphenylpropaneorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazacyclepyrroline carboxylic acid or derivativesorganic 1,3-dipolar compoundpyrrolinehydrocarbon derivativebenzenoidorganic nitrogen compoundcyclic carboximidic acidalkyl-phenylketone |
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