| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:29 UTC |
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| Update Date | 2025-03-25 00:54:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02204636 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H9NOS |
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| Molecular Mass | 191.0405 |
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| SMILES | O=C1SCCC1=Cc1cccnc1 |
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| InChI Key | RQERKQBLWZXHLF-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 | pyridines and derivatives |
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| Subclass | pyridines and derivatives |
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| Direct Parent | pyridines and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarbothioic s-lactonescarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsthioestersthiolactonesthiolanes |
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| Substituents | thiolanecarbothioic s-lactonethiocarboxylic acid or derivativescarbonyl grouparomatic heteromonocyclic compoundazacyclethiocarboxylic acid esterheteroaromatic compoundcarboxylic acid derivativeorganic oxidepyridineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundthiolactoneorganooxygen compound |
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