| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:34:15 UTC |
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| Update Date | 2025-03-24 20:22:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01429426 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C5H9NS |
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| Molecular Mass | 115.0456 |
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| SMILES | CCCCSC#N |
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| InChI Key | HXNXAEYAXNPLHJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | thiocyanates |
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| Subclass | thiocyanates |
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| Direct Parent | thiocyanates |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | cyanide saltshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundssulfenyl compounds |
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| Substituents | aliphatic acyclic compoundsulfenyl compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cyanide saltthiocyanate |
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