| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:12 UTC |
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| Update Date | 2025-03-25 00:56:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02220340 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12OS |
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| Molecular Mass | 168.0609 |
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| SMILES | CSc1ccc(C(C)O)cc1 |
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| InChI Key | XRCBEPLEVWVPAD-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 | alkylarylthioethersaromatic alcoholsbenzene and substituted derivativeshydrocarbon derivativessecondary alcoholssulfenyl compoundsthiophenol ethers |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moietysulfenyl compoundalkylarylthioetherorganosulfur compoundaryl thioetheraromatic homomonocyclic compoundthiophenolorganic oxygen compoundthioetherthiophenol ethersecondary alcoholhydrocarbon derivativeorganooxygen compound |
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