Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:44:40 UTC |
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Update Date | 2025-03-25 00:48:08 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02166319 |
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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 | CC1CC(O)C(C)C(OC(=O)C(C)C)C1 |
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InChI Key | FDCINZJNDWXEGF-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 derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | carbonyl groupcyclohexanolcyclic alcoholcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativescarboxylic acid esteraliphatic homomonocyclic compoundhydrocarbon derivative |
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