| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 17:14:55 UTC |
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| Update Date | 2025-03-25 01:46:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02513955 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H14O2 |
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| Molecular Mass | 130.0994 |
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| SMILES | CC1COOCC1(C)C |
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| InChI Key | XTUZTNUTNGMADC-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 | dialkyl peroxideshydrocarbon derivativesorganooxygen compoundsoxacyclic compounds |
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| Substituents | oxacycleorganic oxygen compounddialkyl peroxidealiphatic heteromonocyclic compoundhydrocarbon derivativeortho-dioxaneorganooxygen compound |
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