| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:37:35 UTC |
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| Update Date | 2025-03-24 20:24:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01437130 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C6H9NOS |
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| Molecular Mass | 143.0405 |
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| SMILES | O=C1NC2CSCCC12 |
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| InChI Key | CIPQFCWKFXPVPD-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 | thianes |
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| Subclass | thianes |
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| Direct Parent | thianes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsazetidinesbeta lactamscarbonyl compoundscarboxylic acids and derivativesdialkylthioethershydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | carbonyl grouplactamazacycledialkylthioethercarboxamide groupcarboxylic acid derivativeazetidinealiphatic heteropolycyclic compoundsecondary carboxylic acid amideorganic oxideorganic oxygen compoundthioetherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundbeta-lactamorganooxygen compoundthiane |
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