| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:17 UTC |
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| Update Date | 2025-03-25 00:47:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02165420 |
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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 | CCC(=O)CC(=O)OC(CC(=O)O)C(=O)O |
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| InChI Key | SJOXTULXQBZWEA-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 | beta-keto acids and derivativescarboxylic acid esterscarboxylic acidsfatty acid estershydrocarbon derivativesketonesorganic oxides |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidtricarboxylic acid or derivativesbeta-keto acidketonefatty acid esterorganic oxideorganic oxygen compoundketo acidcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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