| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:32 UTC |
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| Update Date | 2025-03-25 00:45:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02150056 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H14O8 |
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| Molecular Mass | 250.0689 |
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| SMILES | CCOC(=O)C(O)(C(=O)OC)C(O)C(=O)OC |
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| InChI Key | OJRWOSVERSUGFY-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 | 1,2-diolsbeta hydroxy acids and derivativescarbonyl compoundsfatty acid estershydrocarbon derivativesmethyl estersmonosaccharidesorganic oxidessecondary alcoholstertiary alcohols |
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| Substituents | alcoholfatty acylaliphatic acyclic compoundcarbonyl groupmonosaccharidetricarboxylic acid or derivativeshydroxy acidfatty acid esterbeta-hydroxy acidtertiary alcoholsaccharideorganic oxidemethyl esterorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativeorganooxygen compound1,2-diol |
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