Record Information |
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HMDB Status | expected |
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Creation Date | 2024-02-20 23:41:34 UTC |
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Update Date | 2025-03-21 17:59:06 UTC |
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HMDB ID | HMDB0032391 |
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Metabolite Identification |
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DeepMet ID | DMID00018796 |
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Name | 3-Methyl-3-butenyl acetate |
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Frequency | 219.4 |
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Structure | |
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Chemical Formula | C7H12O2 |
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Molecular Mass | 128.0837 |
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SMILES | C=C(C)CCOC(C)=O |
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InChI Key | OCUAPVNNQFAQSM-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 compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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