| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:33 UTC |
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| Update Date | 2025-03-25 01:00:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02241371 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C4H6Br2O3 |
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| Molecular Mass | 259.8684 |
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| SMILES | CC(O)(C(=O)O)C(Br)Br |
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| InChI Key | APNSQEDNGRSATI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | hydroxy acids and derivatives |
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| Subclass | alpha hydroxy acids and derivatives |
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| Direct Parent | alpha hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl bromidesbromohydrinscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganobromidestertiary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupcarboxylic acidhalohydrinalpha-hydroxy acidcarboxylic acid derivativeorganohalogen compoundalkyl bromidetertiary alcoholorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundbromohydrinorganobromidealkyl halidehydrocarbon derivativeorganooxygen compound |
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