| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:05 UTC |
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| Update Date | 2025-03-25 00:46:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153691 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H9BrO2S |
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| Molecular Mass | 247.9507 |
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| SMILES | CS(=O)(=O)Cc1ccc(Br)cc1 |
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| InChI Key | CCSFLRBJHQPXFL-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 | bromobenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl bromideshydrocarbon derivativesorganic oxidesorganobromidessulfones |
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| Substituents | bromobenzeneorganosulfur compoundorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganic oxidesulfonylorganic oxygen compoundorganobromidehydrocarbon derivativearyl bromidesulfone |
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