| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:00 UTC |
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| Update Date | 2025-03-25 00:46:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02155838 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H9F3S |
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| Molecular Mass | 206.0377 |
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| SMILES | CSCc1cccc(C(F)(F)F)c1 |
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| InChI Key | MFNKXLUGNVPITD-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 | trifluoromethylbenzenes |
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| Direct Parent | trifluoromethylbenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl fluoridesdialkylthioethershydrocarbon derivativesorganofluoridessulfenyl compounds |
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| Substituents | sulfenyl compoundalkyl fluorideorganofluoridedialkylthioetherorganosulfur compoundorganohalogen compoundaromatic homomonocyclic compoundthioetheralkyl halidehydrocarbon derivativetrifluoromethylbenzene |
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