| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:09 UTC |
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| Update Date | 2025-03-21 18:04:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00048521 |
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| Frequency | 68.3 |
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| Structure | |
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| Chemical Formula | C5H8O6 |
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| Molecular Mass | 164.0321 |
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| SMILES | O=C1OOC(CO)C(O)C1O |
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| InChI Key | IERZPYGWQVWNDR-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 | 1,2-dioxanes |
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| Direct Parent | 1,2-dioxanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsprimary alcoholssecondary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic acid derivativeoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeprimary alcoholortho-dioxaneorganooxygen compound |
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