Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:16:25 UTC |
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Update Date | 2025-03-21 18:34:35 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00101557 |
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Frequency | 26.9 |
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Structure | |
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Chemical Formula | C8H14O5 |
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Molecular Mass | 190.0841 |
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SMILES | CCCOC(=O)C(O)C(=O)OCC |
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InChI Key | HOCIDYBGDYERPG-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 | dicarboxylic acids and derivatives |
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Direct Parent | dicarboxylic acids and derivatives |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | 1,3-dicarbonyl compoundscarboxylic acid estershydrocarbon derivativesmonosaccharidesorganic oxidessecondary alcohols |
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Substituents | alcoholaliphatic acyclic compoundcarbonyl groupmonosaccharidesaccharideorganic oxideorganic oxygen compoundcarboxylic acid estersecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivative1,3-dicarbonyl compoundorganooxygen compound |
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