| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:25:39 UTC |
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| Update Date | 2025-03-24 20:04:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01119610 |
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| Frequency | 1.2 |
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| Structure | |
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| Chemical Formula | C3H3NOS2 |
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| Molecular Mass | 132.9656 |
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| SMILES | OC(=S)CN=C=S |
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| InChI Key | SIAACFCDKONBRO-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 | isothiocyanates |
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| Subclass | isothiocyanates |
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| Direct Parent | isothiocyanates |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbodithioic acidscarbonyl compoundscarbothioic o-acidshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundsthiocarbonyl compoundsthiocarboxylic acids and derivatives |
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| Substituents | aliphatic acyclic compoundthiocarboxylic acid or derivativesisothiocyanatecarbonyl groupthiocarbonyl groupcarbodithioic acidorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundorganic oxygen compoundcarbothioic o-acidorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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