| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:22 UTC |
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| Update Date | 2025-03-25 00:47:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158822 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H15NOS |
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| Molecular Mass | 257.0874 |
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| SMILES | Oc1ccc(C2CCSc3ccccc3N2)cc1 |
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| InChI Key | DQHNVZAXOLTSKI-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 | benzothiazepines |
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| Subclass | benzothiazepines |
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| Direct Parent | benzothiazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkylarylthioethersazacyclic compoundsbenzene and substituted derivativeshydrocarbon derivativesorganooxygen compoundsorganopnictogen compoundssecondary alkylarylamines |
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| Substituents | monocyclic benzene moietyazacycle1-hydroxy-2-unsubstituted benzenoidsecondary aminealkylarylthioetheraryl thioethersecondary aliphatic/aromatic amineorganic oxygen compoundaromatic heteropolycyclic compoundthioetherorganonitrogen compoundorganopnictogen compoundphenolhydrocarbon derivativebenzenoidbenzothiazepineorganic nitrogen compoundamineorganooxygen compound |
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