| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:45 UTC |
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| Update Date | 2025-03-25 00:48:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02171018 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H14O4 |
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| Molecular Mass | 198.0892 |
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| SMILES | COC(=O)C1C(=O)CC(C)(C)CC1=O |
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| InChI Key | HGMJETQBLLVMTR-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 | beta-diketones |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | cyclic ketoneshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | cyclic ketonecarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesmethyl estercarboxylic acid esteraliphatic homomonocyclic compoundhydrocarbon derivative1,3-diketone |
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