| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:59:12 UTC |
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| Update Date | 2025-03-21 18:05:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00060282 |
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| Frequency | 52.0 |
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| Structure | |
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| Chemical Formula | C16H32O3 |
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| Molecular Mass | 272.2351 |
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| SMILES | CC(C)C(=O)OC(C(C)C)C(C)(C)COC(C)(C)C |
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| InChI Key | JCEWTMKKGXVUQZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | carboxylic acid derivatives |
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| Direct Parent | carboxylic acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundsdialkyl ethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesetherorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativedialkyl etherorganooxygen compound |
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