| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:05 UTC |
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| Update Date | 2025-03-25 00:55:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02210735 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H9NO2S |
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| Molecular Mass | 183.0354 |
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| SMILES | C=CCS(=O)(=O)c1cccnc1 |
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| InChI Key | LVOUSLGWQNAYOG-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 | allyl sulfur compoundsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfones |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundallyl sulfur compoundorganosulfur compoundorganic oxidesulfonylpyridineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundsulfone |
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