Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:25:11 UTC |
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Update Date | 2025-03-21 18:38:49 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00122795 |
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Frequency | 21.0 |
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Structure | |
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Chemical Formula | C5H8O3 |
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Molecular Mass | 116.0473 |
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SMILES | CC1CCC(=O)OO1 |
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InChI Key | QETOZAORNBJXMA-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organoheterocyclic compounds |
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Class | dioxanes |
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Subclass | 1,2-dioxanes |
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Direct Parent | 1,2-dioxanes |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | carbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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Substituents | oxacyclecarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativecarboxylic acid derivativeortho-dioxaneorganooxygen compound |
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