| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:53:57 UTC |
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| Update Date | 2025-03-21 18:04:02 UTC |
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| HMDB ID | HMDB0039778 |
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| Metabolite Identification |
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| DeepMet ID | DMID00048035 |
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| Name | xi-3,5-Dimethyl-2(5H)-furanone |
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| Frequency | 69.1 |
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| Structure | |
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| Chemical Formula | C6H8O2 |
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| Molecular Mass | 112.0524 |
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| SMILES | CC1=CC(C)OC1=O |
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| InChI Key | SAXRUMLUKZBSTO-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 | dihydrofurans |
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| Subclass | furanones |
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| Direct Parent | butenolides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundsdihydrofuransenoate estershydrocarbon derivativeslactonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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| Substituents | enoate estercarbonyl groupcarboxylic acid derivativelactoneoxacyclealpha,beta-unsaturated carboxylic ester2-furanoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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