| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:09:30 UTC |
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| Update Date | 2025-03-21 23:09:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00649832 |
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| Frequency | 2.4 |
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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=C(O)C(O)CC1O |
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| InChI Key | IJYHRGSMUXAPPC-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 | carbonyl compounds |
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| Direct Parent | cyclohexenones |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | cyclitols and derivativeshydrocarbon derivativesorganic oxidessecondary alcoholsvinylogous acids |
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| Substituents | alcoholcyclohexenonecyclitol or derivativesvinylogous acidorganic oxidesecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivative |
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