Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 17:10:31 UTC |
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Update Date | 2025-03-25 01:44:30 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02503676 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C7H8O2 |
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Molecular Mass | 124.0524 |
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SMILES | C=CC1OC=C(C)C1=O |
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InChI Key | PHCGQOZYMQUUFU-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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