| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:25:43 UTC |
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| Update Date | 2025-03-25 01:25:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02398496 |
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| Frequency | 0.5 |
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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=C1C2OCC(CO2)C1O |
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| InChI Key | CDALKLJPDVQJNW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | dioxanes |
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| Subclass | 1,3-dioxanes |
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| Direct Parent | 1,3-dioxanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | acetalshydrocarbon derivativesketonesorganic oxidesoxacyclic compoundsoxanessecondary alcohols |
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| Substituents | alcoholcarbonyl groupketonealiphatic heteropolycyclic compoundoxacycleorganic oxideorganic oxygen compoundacetalsecondary alcoholhydrocarbon derivativeoxanemeta-dioxaneorganooxygen compound |
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