| Record Information |
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| HMDB Status | predicted |
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| Creation Date | 2024-02-21 00:06:24 UTC |
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| Update Date | 2025-03-21 18:29:28 UTC |
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| HMDB ID | HMDB0128916 |
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| Metabolite Identification |
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| DeepMet ID | DMID00077553 |
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| Name | 4-hydroxy-3-methylbut-2-enoic acid |
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| Frequency | 37.8 |
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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 | CC(=CC(=O)O)CO |
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| InChI Key | BERUOTKXCOOJJM-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | hydroxy fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alcohols and polyolscarbonyl compoundscarboxylic acidshydrocarbon derivativesmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidesshort-chain hydroxy acids and derivativesunsaturated fatty acids |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupcarboxylic acidmethyl-branched fatty acidshort-chain hydroxy acidcarboxylic acid derivativebranched fatty acidunsaturated fatty acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativehydroxy fatty acidorganooxygen compound |
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