| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:14 UTC |
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| Update Date | 2025-03-25 01:01:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02252234 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H8F3NO |
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| Molecular Mass | 191.0558 |
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| SMILES | NC(O)(c1ccccc1)C(F)(F)F |
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| InChI Key | JDQLDZJIEGWKBA-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 | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkanolaminesalkyl fluoridesaromatic alcoholsfluorohydrinshydrocarbon derivativesmonoalkylaminesorganofluoridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aromatic alcoholmonocyclic benzene moietyhalohydrinalkyl fluorideorganofluoridefluorohydrinorganohalogen compoundaromatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundalkyl halidehydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundalkanolamine |
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