| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:47 UTC |
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| Update Date | 2025-03-25 00:58:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232804 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H14O7 |
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| Molecular Mass | 234.074 |
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| SMILES | CCC(=O)OC1(C(=O)O)CC(O)C(O)C1O |
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| InChI Key | KGSDRWPEZXOTOA-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 | beta hydroxy acids and derivatives |
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| Direct Parent | beta hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid esterscarboxylic acidscyclitols and derivativescyclopentanolsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxides |
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| Substituents | alcoholcarbonyl groupcarboxylic acidcyclitol or derivativescyclic alcoholcarboxylic acid derivativecyclopentanolbeta-hydroxy acidorganic oxideorganic oxygen compoundcarboxylic acid estersecondary alcoholaliphatic homomonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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