| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:48:22 UTC |
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| Update Date | 2025-03-25 00:49:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02174724 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H17NOS |
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| Molecular Mass | 223.1031 |
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| SMILES | CCCC1CSC(c2ccc(O)cc2)N1 |
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| InChI Key | RAIIRXQBNRGLSB-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 | phenols |
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| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzene and substituted derivativesdialkylaminesdialkylthioethershydrocarbon derivativesorganooxygen compoundsorganopnictogen compoundsthiazolidines |
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| Substituents | secondary aliphatic aminemonocyclic benzene moietyaromatic heteromonocyclic compoundazacycledialkylthioether1-hydroxy-2-unsubstituted benzenoidsecondary amineorganic oxygen compoundthioetherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundaminethiazolidine |
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