| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 08:09:39 UTC |
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| Update Date | 2025-03-24 22:31:31 UTC |
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| HMDB ID | HMDB0246077 |
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| Metabolite Identification |
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| DeepMet ID | DMID01226899 |
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| Name | 3,6-Dimethyl-1,4-dioxane-2,5-dione |
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| Frequency | 1.1 |
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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 | CC1OC(=O)C(C)OC1=O |
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| InChI Key | JJTUDXZGHPGLLC-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 | 1,4-dioxanes |
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| Direct Parent | 1,4-dioxanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estersdicarboxylic acids and derivativeshydrocarbon derivativeslactonesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl groupcarboxylic acid derivativelactoneoxacycleorganic oxideorganic oxygen compoundpara-dioxanecarboxylic acid esteraliphatic heteromonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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