| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:28 UTC |
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| Update Date | 2025-03-25 00:56:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02218622 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H14F2O |
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| Molecular Mass | 308.1013 |
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| SMILES | Fc1ccc(C2(c3ccc(F)cc3)OCc3ccccc32)cc1 |
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| InChI Key | PHGTVKSOYIVBNG-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 | isocoumarans |
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| Subclass | isocoumarans |
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| Direct Parent | isocoumarans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl fluoridesdialkyl ethersfluorobenzeneshydrocarbon derivativesorganofluoridesoxacyclic compounds |
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| Substituents | aryl fluoridemonocyclic benzene moietyetherorganofluorideorganohalogen compounddialkyl etheraryl halideoxacyclefluorobenzeneisocoumaranorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoidhalobenzeneorganooxygen compound |
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