| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:35:40 UTC |
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| Update Date | 2025-03-21 17:57:03 UTC |
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| HMDB ID | HMDB0245333 |
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| Metabolite Identification |
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| DeepMet ID | DMID00005380 |
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| Name | 2,2-Dimethylbutyric acid |
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| Frequency | 997.7 |
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| Structure | |
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| Chemical Formula | C6H12O2 |
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| Molecular Mass | 116.0837 |
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| SMILES | CCC(C)(C)C(=O)O |
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| InChI Key | VUAXHMVRKOTJKP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | methyl-branched fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidmethyl-branched fatty acidcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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