| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:07 UTC |
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| Update Date | 2025-03-25 00:50:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02181086 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H8O7 |
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| Molecular Mass | 204.027 |
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| SMILES | O=C(O)CC(C(=O)CO)C(=O)C(=O)O |
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| InChI Key | FBKYNHBWWYVLIY-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 | keto acids and derivatives |
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| Subclass | gamma-keto acids and derivatives |
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| Direct Parent | gamma-keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alcohols and polyolsalpha-hydroxy ketonesalpha-keto acids and derivativesbeta-diketonesbranched fatty acidscarboxylic acidsdicarboxylic acids and derivativesfatty acylshydrocarbon derivativeshydroxy fatty acidsmonosaccharidesorganic oxidesshort-chain keto acids and derivatives |
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| Substituents | alcoholfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidmonosaccharideshort-chain keto acidalpha-hydroxy ketonecarboxylic acid derivativebranched fatty acidgamma-keto acidketonesaccharideorganic oxideorganic oxygen compoundalpha-keto aciddicarboxylic acid or derivativeshydrocarbon derivativehydroxy fatty acid1,3-dicarbonyl compound1,3-diketoneorganooxygen compound |
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