| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:09 UTC |
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| Update Date | 2025-03-25 00:45:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02149145 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H13NO2S |
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| Molecular Mass | 235.0667 |
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| SMILES | CS(=O)C(=O)CCc1c[nH]c2ccccc12 |
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| InChI Key | XZYNBDVUJJVSQE-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 | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolessulfinyl compoundssulfoxidesthiolactones |
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| Substituents | carbonyl groupazacycleindoleheteroaromatic compoundorganosulfur compoundcarboxylic acid derivativeorganic oxideorganic oxygen compoundsulfinyl compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundsulfoxideorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundthiolactoneorganooxygen compound |
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