Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 03:13:03 UTC |
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Update Date | 2025-03-21 22:12:29 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00515894 |
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Frequency | 3.3 |
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Structure | |
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Chemical Formula | C5H10O3 |
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Molecular Mass | 118.063 |
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SMILES | CCC(O)COC=O |
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InChI Key | MHFOHBLKZMXGRZ-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 oxidessecondary alcohols |
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Substituents | alcoholaliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativeorganooxygen compound |
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