| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:21:54 UTC |
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| Update Date | 2025-03-24 21:08:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01686833 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C6H8O3 |
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| Molecular Mass | 128.0473 |
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| SMILES | O=C1OC2CCC1OC2 |
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| InChI Key | LOTKVWRWXFGIJD-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 | delta valerolactones |
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| Direct Parent | delta valerolactones |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | 1,4-dioxanescarbonyl compoundscarboxylic acid estersdialkyl ethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxanes |
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| Substituents | carbonyl groupetherdelta valerolactonecarboxylic acid derivativedialkyl etheraliphatic heteropolycyclic compoundoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundpara-dioxanecarboxylic acid esterhydrocarbon derivativeoxanedelta_valerolactoneorganooxygen compound |
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