Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:16 UTC |
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Update Date | 2025-03-21 18:35:02 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00103643 |
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Frequency | 26.2 |
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Structure | |
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Chemical Formula | C11H11NO |
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Molecular Mass | 173.0841 |
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SMILES | O=C(c1ccccc1)C1CCC=N1 |
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InChI Key | XBPMYQBIGNWJHS-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 derivativeshydrocarbon derivativesiminesorganic oxidesorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrroline carboxylic acids and derivatives |
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Substituents | monocyclic benzene moietyaryl alkyl ketonearomatic heteromonocyclic compoundazacycleiminepyrroline carboxylic acid or derivativesbenzoylorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundorganic oxidepyrrolineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundalkyl-phenylketoneorganoheterocyclic compound |
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