| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:27:56 UTC |
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| Update Date | 2025-03-21 18:40:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00129265 |
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| Frequency | 19.7 |
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| Structure | |
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| Chemical Formula | C11H14O2 |
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| Molecular Mass | 178.0994 |
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| SMILES | O=C(CCCCO)c1ccccc1 |
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| InChI Key | JDXNTJVIHPAPPZ-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 homomonocyclic compounds |
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| Alternative Parents | alcohols and polyolsaryl alkyl ketonesbenzoyl derivativesbutyrophenonesfatty alcoholshydrocarbon derivativesorganic oxides |
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| Substituents | alcoholfatty acylmonocyclic benzene moietyaryl alkyl ketonebenzoylbutyrophenonearomatic homomonocyclic compoundorganic oxidefatty alcoholhydrocarbon derivativebenzenoidalkyl-phenylketone |
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