| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:29 UTC |
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| Update Date | 2025-03-21 18:36:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00109114 |
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| Frequency | 24.5 |
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| Structure | |
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| Chemical Formula | C5H6O4 |
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| Molecular Mass | 130.0266 |
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| SMILES | O=C(O)C1=COCCO1 |
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| InChI Key | ZZHGJPGNSHXDJV-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 | dioxins |
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| Subclass | para dioxins |
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| Direct Parent | para dioxins |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsvinylogous esters |
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| Substituents | carbonyl groupcarboxylic acidvinylogous estercarboxylic acid derivativeoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundpara-dioxinaliphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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