| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:52:35 UTC |
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| Update Date | 2025-03-21 18:03:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00044754 |
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| Frequency | 75.5 |
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| Structure | |
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| Chemical Formula | C6H8O6 |
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| Molecular Mass | 176.0321 |
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| SMILES | O=CCC(O)(CC(=O)O)C(=O)O |
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| InChI Key | QRTDTRCGZCHEER-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 | alpha hydroxy acids and derivativesalpha-hydrogen aldehydesbeta-hydroxy aldehydesbranched fatty acidscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesshort-chain hydroxy acids and derivativestertiary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundbeta-hydroxy aldehydecarbonyl groupcarboxylic acidshort-chain hydroxy acidalpha-hydroxy acidaldehydehydroxy acidcarboxylic acid derivativebranched fatty acidtertiary alcoholorganic oxideorganic oxygen compoundalpha-hydrogen aldehydedicarboxylic acid or derivativeshydrocarbon derivativehydroxy fatty acidorganooxygen compound |
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