| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:58 UTC |
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| Update Date | 2025-03-25 00:45:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02151067 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H17NO3S |
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| Molecular Mass | 255.0929 |
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| SMILES | COc1ccc(C2CN(C)CCS2(=O)=O)cc1 |
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| InChI Key | LEBIBBYUVHCLBT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | thiazinanes |
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| Subclass | thiomorpholines |
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| Direct Parent | phenylthiomorpholines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundshydrocarbon derivativesmethoxybenzenesorganic oxidesorganopnictogen compoundsphenoxy compoundssulfonestrialkylamines |
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| Substituents | phenol ethermonocyclic benzene moietyetheraromatic heteromonocyclic compoundalkyl aryl etherorganic oxideorganonitrogen compoundorganopnictogen compoundtertiary amineazacycletertiary aliphatic amine2-phenylthiomorpholinemethoxybenzeneorganic oxygen compoundanisolehydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundamineorganooxygen compoundsulfone |
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