| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:46 UTC |
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| Update Date | 2025-03-25 00:56:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02221638 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C36H32FNO5 |
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| Molecular Mass | 577.2265 |
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| SMILES | O=C(O)CC(O)CC(O)CCn1c(C(=O)c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)c1-c1ccc(F)cc1 |
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| InChI Key | VCKZKUZBAXALFB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl-phenylketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl fluoridesaryl ketonesazacyclic compoundsbenzoyl derivativesbeta hydroxy acids and derivativescarboxylic acidsfluorobenzeneshalogenated fatty acidsheteroaromatic compoundsheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonocarboxylic acids and derivativesorganic oxidesorganofluoridesorganonitrogen compoundsorganopnictogen compoundssecondary alcoholssubstituted pyrroles |
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| Substituents | aryl fluoridefatty acylmonocyclic benzene moietycarboxylic acidaromatic heteromonocyclic compoundheterocyclic fatty acidbenzoylfatty acidsubstituted pyrrolecarboxylic acid derivativeorganohalogen compoundmedium-chain hydroxy acidbeta-hydroxy acidfluorobenzeneorganic oxideorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidhydroxy fatty acidorganoheterocyclic compoundalcoholhalogenated fatty acidazacycleorganofluoridearyl-phenylketoneheteroaromatic compoundhydroxy acidaryl halidemonocarboxylic acid or derivativespyrrolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzene |
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