| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:59:21 UTC |
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| Update Date | 2025-03-24 22:26:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01201113 |
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| Frequency | 1.1 |
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| Structure | |
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| Chemical Formula | C4H8O5 |
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| Molecular Mass | 136.0372 |
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| SMILES | CC(O)C(OO)C(=O)O |
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| InChI Key | NDXKNNMSMQPRAR-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 | hydroperoxy fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl hydroperoxidesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativeshydroxy fatty acidsmonocarboxylic acids and derivativesorganic oxidesperoxolssecondary alcoholsshort-chain hydroxy acids and derivatives |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidhydroperoxidehydroxy acidcarboxylic acid derivativeperoxolbeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesalkyl hydroperoxideorganic oxygen compoundsecondary alcoholhydrocarbon derivativehydroxy fatty acidhydroperoxy fatty acidorganooxygen compound |
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