| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:01 UTC |
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| Update Date | 2025-03-25 00:59:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02237876 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12O7 |
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| Molecular Mass | 232.0583 |
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| SMILES | O=C(O)CC1CC(O)C(O)C(=O)C1C(=O)O |
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| InChI Key | KDWVRQQZOKPZEO-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 | dicarboxylic acids and derivatives |
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| Direct Parent | dicarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | 1,2-diols1,3-dicarbonyl compoundscarboxylic acidscyclic alcohols and derivativescyclic ketoneshydrocarbon derivativesorganic oxidessecondary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic acidcyclic ketonecyclic alcoholketoneorganic oxideorganic oxygen compoundsecondary alcoholaliphatic homomonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivative1,3-dicarbonyl compoundorganooxygen compound1,2-diol |
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