| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:53 UTC |
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| Update Date | 2025-03-21 18:03:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00043063 |
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| Frequency | 79.1 |
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| Structure | |
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| Chemical Formula | C6H6O7 |
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| Molecular Mass | 190.0114 |
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| SMILES | O=C(O)C(=O)CC(C(=O)O)C(=O)O |
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| InChI Key | ZPRZVKKFPMKPGH-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 | carboxylic acids and derivatives |
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| Subclass | tricarboxylic acids and derivatives |
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| Direct Parent | tricarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compoundsalpha-hydroxy ketonesalpha-keto acids and derivativescarboxylic acidsgamma-keto acids and derivativeshydrocarbon derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidtricarboxylic acid or derivativesalpha-hydroxy ketonegamma-keto acidketoneorganic oxideorganic oxygen compoundketo acidalpha-keto acidhydrocarbon derivative1,3-dicarbonyl compoundorganooxygen compound |
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