| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:48:27 UTC |
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| Update Date | 2025-03-21 18:01:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00034797 |
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| Frequency | 103.1 |
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| Structure | |
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| Chemical Formula | C11H12F2N2O |
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| Molecular Mass | 226.0918 |
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| SMILES | NCCc1c[nH]c2ccc(OC(F)F)cc12 |
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| InChI Key | FKRYKLUVGAZHDL-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 | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl fluoridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganofluoridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsphenol etherspyrroles |
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| Substituents | phenol etherazacycleindolealkyl fluorideorganofluorideheteroaromatic compoundorganohalogen compoundorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundalkyl halidehydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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