| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:23 UTC |
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| Update Date | 2025-03-25 00:49:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177108 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H14N2OS |
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| Molecular Mass | 234.0827 |
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| SMILES | CC(=S)NCCc1c[nH]c2ccc(O)cc12 |
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| InChI Key | LDUCCYDLFJGRLE-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 | 1-hydroxy-2-unsubstituted benzenoidsazacyclic compoundsbenzenoidscarbonyl compoundsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundspyrrolesthioamidesthiocarbonyl compoundsthiocarboxylic acid amides |
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| Substituents | carbonyl groupazacyclethiocarboxylic acid amideindoleheteroaromatic compoundthiocarbonyl group1-hydroxy-2-unsubstituted benzenoidorganosulfur compoundorganic oxygen compoundthioamidearomatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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