| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:27:19 UTC |
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| Update Date | 2025-03-21 18:39:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00127809 |
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| Frequency | 20.0 |
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| Structure | |
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| Chemical Formula | C11H14O |
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| Molecular Mass | 162.1045 |
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| SMILES | CCc1ccc(C(C)=O)c(C)c1 |
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| InChI Key | VBQQVSSUCOEDAP-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 | acetophenonesaryl alkyl ketonesbenzoyl derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundstoluenes |
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| Substituents | monocyclic benzene moietyaryl alkyl ketonebenzoylaromatic homomonocyclic compoundorganic oxideacetophenonehydrocarbon derivativebenzenoidtoluenealkyl-phenylketone |
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