Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 02:48:47 UTC |
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Update Date | 2025-03-21 21:58:44 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00458740 |
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Frequency | 3.8 |
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Structure | |
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Chemical Formula | C4H6N2S |
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Molecular Mass | 114.0252 |
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SMILES | CNc1nccs1 |
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InChI Key | DWVCPSQPTSNMRX-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic nitrogen compounds |
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Class | organonitrogen compounds |
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Subclass | amines |
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Direct Parent | secondary alkylarylamines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganopnictogen compoundsthiazoles |
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Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundsecondary aliphatic/aromatic amineorganopnictogen compoundhydrocarbon derivativethiazoleorganoheterocyclic compoundazole |
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