Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 01:02:51 UTC |
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Update Date | 2025-03-21 19:01:54 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00210829 |
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Frequency | 10.4 |
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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 | O=C(O)CC1(O)CC1 |
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InChI Key | KFZBWDNJUMVKMC-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | alcohols and polyols |
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Direct Parent | tertiary alcohols |
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Geometric Descriptor | aliphatic homomonocyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acidscyclic alcohols and derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | carbonyl groupcarboxylic acidcarboxylic acid derivativetertiary alcoholorganic oxidemonocarboxylic acid or derivativesaliphatic homomonocyclic compoundhydrocarbon derivativecyclopropanol |
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