| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:35:04 UTC |
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| Update Date | 2025-03-24 20:49:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01574917 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C6H6O2 |
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| Molecular Mass | 110.0368 |
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| SMILES | C=C1OC(C)=CC1=O |
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| InChI Key | KBGUBPZSYSYPMW-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 | furanones |
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| Direct Parent | furanones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | cyclic ketoneshydrocarbon derivativesorganic oxidesoxacyclic compoundsvinylogous esters |
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| Substituents | carbonyl groupvinylogous estercyclic ketoneketoneoxacycleorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivative3-furanoneorganooxygen compound |
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