| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:31:46 UTC |
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| Update Date | 2025-03-25 00:19:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01280226 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C6H5NS |
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| Molecular Mass | 123.0143 |
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| SMILES | N#CCc1cccs1 |
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| InChI Key | CLSHQIDDCJTHAJ-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 | heteroaromatic compounds |
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| Subclass | heteroaromatic compounds |
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| Direct Parent | heteroaromatic compounds |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativesnitrilesorganonitrogen compoundsorganopnictogen compoundsthiophenes |
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| Substituents | nitrilearomatic heteromonocyclic compoundheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundthiophenecarbonitrile |
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