| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:06:23 UTC |
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| Update Date | 2025-03-24 14:11:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00785838 |
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| Frequency | 1.9 |
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| Structure | |
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| Chemical Formula | C6H8O4 |
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| Molecular Mass | 144.0423 |
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| SMILES | O=C1C=CC(O)(CO)C1O |
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| InChI Key | ITGKTFOGGJUADF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | alcohols and polyols |
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| Direct Parent | tertiary alcohols |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | cyclic ketoneshydrocarbon derivativesorganic oxidessecondary alcohols |
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| Substituents | ketonecarbonyl grouptertiary alcoholorganic oxidesecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivativecyclic ketone |
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