| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:27 UTC |
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| Update Date | 2025-03-21 18:36:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00111461 |
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| Frequency | 23.9 |
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| Structure | |
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| Chemical Formula | C14H12F2O3 |
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| Molecular Mass | 266.0755 |
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| SMILES | CC(C(=O)O)c1ccc2cc(OC(F)F)ccc2c1 |
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| InChI Key | XIVAHTYZNMRKKJ-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 | naphthalenes |
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| Subclass | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | alkyl fluoridescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganofluoridesphenol ethers |
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| Substituents | phenol ethercarbonyl groupcarboxylic acidalkyl fluorideorganofluoridearomatic homopolycyclic compoundcarboxylic acid derivativeorganohalogen compoundorganic oxidemonocarboxylic acid or derivativesnaphthaleneorganic oxygen compoundalkyl halidehydrocarbon derivativeorganooxygen compound |
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