| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:25 UTC |
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| Update Date | 2025-03-21 18:04:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00049133 |
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| Frequency | 67.2 |
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| Structure | |
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| Chemical Formula | C9H12S |
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| Molecular Mass | 152.066 |
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| SMILES | CSc1ccc(C)c(C)c1 |
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| InChI Key | ICBFAPOIXKAENG-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 | thiophenols |
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| Subclass | thiophenols |
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| Direct Parent | thiophenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkylarylthioethershydrocarbon derivativessulfenyl compoundsthiophenol etherso-xylenes |
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| Substituents | monocyclic benzene moietysulfenyl compoundalkylarylthioetherorganosulfur compoundaryl thioetheraromatic homomonocyclic compoundxyleneo-xylenethiophenolthioetherthiophenol etherhydrocarbon derivative |
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