| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:37 UTC |
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| Update Date | 2025-03-25 01:01:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02250811 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C28H26F2N2O5 |
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| Molecular Mass | 508.181 |
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| SMILES | O=C(O)CC(O)CC(O)CCn1c(-c2ccc(F)cc2)nc(-c2cccc(O)c2)c1-c1ccc(F)cc1 |
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| InChI Key | KERLDCAZAHVHCN-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 | azoles |
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| Subclass | imidazoles |
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| Direct Parent | phenylimidazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl fluoridesazacyclic compoundsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsfluorobenzeneshalogenated fatty acidsheteroaromatic compoundsheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidsimidazolesmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonocarboxylic acids and derivativesn-substituted imidazolesorganic oxidesorganofluoridesorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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| Substituents | aryl fluoridefatty acylmonocyclic benzene moietycarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundheterocyclic fatty acid1-hydroxy-2-unsubstituted benzenoidfatty acidcarboxylic acid derivativeorganohalogen compoundmedium-chain hydroxy acid4-phenylimidazolebeta-hydroxy acidfluorobenzeneorganic oxideorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidhydroxy fatty acidn-substituted imidazolealcoholhalogenated fatty acidazacycleorganofluorideheteroaromatic compoundhydroxy acid1-hydroxy-4-unsubstituted benzenoidaryl halide5-phenylimidazolemonocarboxylic acid or derivativesorganic oxygen compound2-phenylimidazolesecondary alcoholphenolhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneorganooxygen compound |
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