| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:47:35 UTC |
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| Update Date | 2025-03-21 18:01:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00032739 |
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| Frequency | 111.3 |
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| Structure | |
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| Chemical Formula | C7H10O6 |
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| Molecular Mass | 190.0477 |
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| SMILES | CC(=O)C(O)(CC(=O)O)CC(=O)O |
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| InChI Key | XNKUYILSHPVDFD-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 | keto acids and derivatives |
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| Subclass | gamma-keto acids and derivatives |
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| Direct Parent | gamma-keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acyloinsalpha-hydroxy ketonesbranched fatty acidscarboxylic acidsdicarboxylic acids and derivativesfatty acylshydrocarbon derivativeshydroxy fatty acidsorganic oxidesshort-chain keto acids and derivativestertiary alcohols |
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| Substituents | alcoholfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain keto acidalpha-hydroxy ketonecarboxylic acid derivativebranched fatty acidgamma-keto acidketonetertiary alcoholorganic oxideorganic oxygen compoundacyloindicarboxylic acid or derivativeshydrocarbon derivativehydroxy fatty acidorganooxygen compound |
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