| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:14 UTC |
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| Update Date | 2025-03-25 00:59:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02238340 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H19FO3 |
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| Molecular Mass | 266.1318 |
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| SMILES | O=C(O)CCC1CCC(O)(c2ccc(F)cc2)CC1 |
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| InChI Key | BRIYREQNMBVVOO-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 | benzene and substituted derivatives |
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| Subclass | halobenzenes |
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| Direct Parent | fluorobenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl fluoridescarbonyl compoundscarboxylic acidscyclic alcohols and derivativescyclohexanolshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganofluoridestertiary alcohols |
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| Substituents | aryl fluoridealcoholcarbonyl groupcarboxylic acidorganofluoridecyclohexanolcyclic alcoholcarboxylic acid derivativeorganohalogen compoundaryl halidearomatic homomonocyclic compoundfluorobenzenetertiary alcoholorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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