| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:44:48 UTC |
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| Update Date | 2025-03-25 00:24:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01310654 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C6H6O3 |
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| Molecular Mass | 126.0317 |
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| SMILES | O=CC=C1CCC(=O)O1 |
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| InChI Key | JBFHDQZNIWVFAV-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 | tetrahydrofurans |
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| Subclass | tetrahydrofurans |
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| Direct Parent | tetrahydrofurans |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | aldehydesenol estershydrocarbon derivativeslactonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl grouptetrahydrofuranaldehydecarboxylic acid derivativelactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundhydrocarbon derivativeenol esterorganooxygen compound |
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