| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:15 UTC |
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| Update Date | 2025-03-25 00:49:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02172168 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H10ClNS |
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| Molecular Mass | 199.0222 |
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| SMILES | CN1CCSc2cc(Cl)ccc21 |
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| InChI Key | MSNWKACOXAKQNY-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 | benzothiazines |
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| Subclass | benzothiazines |
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| Direct Parent | benzothiazines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,4-thiazinesalkylarylthioethersaryl chloridesazacyclic compoundsbenzenoidsdialkylarylamineshydrocarbon derivativesorganochloridesorganopnictogen compounds |
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| Substituents | aryl chloridepara-thiazineazacycleorganochloridebenzothiazinealkylarylthioetherorganohalogen compoundaryl thioetheraryl halidearomatic heteropolycyclic compoundthioethertertiary aliphatic/aromatic amineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compounddialkylarylamineaminetertiary amine |
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