| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:28:05 UTC |
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| Update Date | 2025-03-21 18:40:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00129644 |
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| Frequency | 19.6 |
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| Structure | |
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| Chemical Formula | C12H14O |
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| Molecular Mass | 174.1045 |
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| SMILES | C=CC(=O)c1cccc(C(C)C)c1 |
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| InChI Key | JEIHTIFAPLDMFY-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 | cumenes |
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| Direct Parent | cumenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alpha,beta-unsaturated ketonesaryl ketonesbenzoyl derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundsphenylpropanes |
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| Substituents | benzoylalpha,beta-unsaturated ketoneketonephenylpropanearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundcumenehydrocarbon derivativeorganooxygen compoundaryl ketone |
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