| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:20 UTC |
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| Update Date | 2025-03-25 00:58:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02231756 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H15NO2S |
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| Molecular Mass | 225.0824 |
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| SMILES | CC1(c2ccc(S(C)(=O)=O)cc2)CNC1 |
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| InChI Key | DRKVVALLZQKMJL-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 | azetidines |
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| Subclass | phenylazetidines |
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| Direct Parent | phenylazetidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenesulfonyl compoundsdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundssulfones |
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| Substituents | secondary aliphatic aminemonocyclic benzene moietyaromatic heteromonocyclic compoundazacycle3-phenylazetidinesecondary amineorganosulfur compoundorganic oxidesulfonylorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundaminesulfonebenzenesulfonyl group |
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