| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:55 UTC |
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| Update Date | 2025-03-25 00:59:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235443 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H4FNO2 |
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| Molecular Mass | 141.0226 |
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| SMILES | O=[N+]([O-])c1ccc(F)cc1 |
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| InChI Key | WFQDTOYDVUWQMS-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | nitrobenzenes |
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| Direct Parent | nitrobenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl fluoridesfluorobenzeneshydrocarbon derivativesnitroaromatic compoundsorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganofluoridesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | aryl fluorideallyl-type 1,3-dipolar organic compoundorganohalogen compoundorganic nitro compoundpropargyl-type 1,3-dipolar organic compoundfluorobenzeneorganic oxidec-nitro compoundorganonitrogen compoundorganopnictogen compoundorganic oxoazaniumnitrobenzenenitroaromatic compoundorganofluorideorganic 1,3-dipolar compoundaryl halidearomatic homomonocyclic compoundorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzeneorganic hyponitrite |
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