| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:22:35 UTC |
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| Update Date | 2025-03-21 22:16:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00538720 |
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| Frequency | 3.1 |
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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 | CC(=O)C1=CCC(=O)O1 |
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| InChI Key | VZVRKKWASHPCHA-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 | dihydrofurans |
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| Subclass | dihydrofurans |
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| Direct Parent | dihydrofurans |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | enol estershydrocarbon derivativesketoneslactonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl groupcarboxylic acid derivativeketonelactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundhydrocarbon derivativeenol esterorganooxygen compounddihydrofuran |
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