| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:26:31 UTC |
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| Update Date | 2025-03-21 20:55:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00405739 |
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| Frequency | 4.5 |
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| Structure | |
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| Chemical Formula | C6H12O3 |
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| Molecular Mass | 132.0786 |
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| SMILES | CCCCOOC(C)=O |
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| InChI Key | ZKERZZMUXBDEOG-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 | peroxycarboxylic acids and derivatives |
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| Direct Parent | peroxycarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetate saltscarbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganic salts |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundacetate saltperoxycarboxylic acid or derivativeshydrocarbon derivativeorganic saltorganooxygen compound |
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