| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:19:20 UTC |
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| Update Date | 2025-03-25 01:23:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02383820 |
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| Frequency | 0.5 |
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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=C1CC(O)C2OC2O1 |
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| InChI Key | VAFKJVCYHLRVNI-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 | epoxides |
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| Subclass | enol ester epoxides |
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| Direct Parent | enol ester epoxides |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-dioxepanescarbonyl compoundscarboxylic acid estersdelta valerolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxanessecondary alcohols |
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| Substituents | alcohol1,3-dioxepanecarbonyl groupdelta valerolactonecarboxylic acid derivativedioxepanelactonealiphatic heteropolycyclic compoundoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativeenol ester epoxideoxanedelta_valerolactoneorganooxygen compound |
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