Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 13:10:44 UTC |
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Update Date | 2025-03-24 21:57:29 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01944626 |
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Frequency | 0.6 |
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Structure | |
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Chemical Formula | C6H8O3 |
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Molecular Mass | 128.0473 |
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SMILES | C=CC(C)=C(O)C(=O)O |
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InChI Key | ZLRBIEPVEFXQSG-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 | carbonyl compoundscarboxylic acidshydrocarbon derivativesmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidesshort-chain hydroxy acids and derivativesunsaturated fatty acids |
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Substituents | aliphatic 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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