| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:21:10 UTC |
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| Update Date | 2025-03-24 20:17:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01397627 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C9H12O |
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| Molecular Mass | 136.0888 |
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| SMILES | CC1=C(C(C)C)C=CC1=O |
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| InChI Key | DJWIGSXFAARICB-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 | cyclic ketones |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganic oxides |
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| Substituents | organic oxidealiphatic homomonocyclic compoundhydrocarbon derivativecyclic ketone |
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