Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:24:21 UTC |
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Update Date | 2025-03-21 18:38:25 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00120804 |
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Frequency | 21.5 |
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Structure | |
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Chemical Formula | C4H8O5 |
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Molecular Mass | 136.0372 |
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SMILES | OC1COOC(O)C1O |
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InChI Key | YNEFLBQETUUEOP-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 | 1,2-diolsdialkyl peroxideshydrocarbon derivativesoxacyclic compoundssecondary alcohols |
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Substituents | alcoholoxacycleorganic oxygen compounddialkyl peroxidealiphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeortho-dioxaneorganooxygen compound1,2-diol |
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