| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:50:56 UTC |
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| Update Date | 2025-03-25 00:26:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01325463 |
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| Frequency | 1.0 |
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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 | O=C1OC2C1CC(O)C2O |
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| InChI Key | FPXZJLCXMOEBAT-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 | lactones |
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| Subclass | beta propiolactones |
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| Direct Parent | beta propiolactones |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-diolscarbonyl compoundscarboxylic acid esterscyclic alcohols and derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxepanesoxetanessecondary alcohols |
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| Substituents | alcoholcarbonyl groupcyclic alcoholcarboxylic acid derivativebeta_propiolactonealiphatic heteropolycyclic compoundoxepaneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteroxetanesecondary alcoholhydrocarbon derivativeorganooxygen compound1,2-diol |
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