| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:13:43 UTC |
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| Update Date | 2025-03-21 18:33:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00094897 |
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| Frequency | 29.3 |
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| Structure | |
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| Chemical Formula | C26H31FN2O4 |
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| Molecular Mass | 454.2268 |
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| SMILES | Cc1ccc(-c2nc(C(C)C)n(CCC(O)CC(O)CC(=O)O)c2-c2ccc(F)cc2)cc1 |
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| InChI Key | VSKRUPCFOYYYTQ-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 | aryl 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 alcoholstoluenes |
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| Substituents | aryl fluoridefatty acylmonocyclic benzene moietycarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundheterocyclic fatty acidfatty acidcarboxylic acid derivativeorganohalogen compoundmedium-chain hydroxy acid4-phenylimidazolebeta-hydroxy acidfluorobenzeneorganic oxideorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidhydroxy fatty acidn-substituted imidazolealcoholhalogenated fatty acidazacycleorganofluorideheteroaromatic compoundhydroxy acidaryl halide5-phenylimidazolemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzenetolueneorganooxygen compound |
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