| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:47 UTC |
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| Update Date | 2025-03-25 00:58:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232776 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H22O3 |
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| Molecular Mass | 214.1569 |
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| SMILES | CCC(C)(C)C(=O)OC1CCCC(O)C1 |
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| InChI Key | ODABOJBRZJSHDN-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 | alcohols and polyols |
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| Direct Parent | cyclohexanols |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid esterscyclic alcohols and derivativesfatty acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | fatty acylcarbonyl groupcyclohexanolcyclic alcoholcarboxylic acid derivativefatty acid esterorganic oxidemonocarboxylic acid or derivativescarboxylic acid esteraliphatic homomonocyclic compoundhydrocarbon derivative |
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