| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:31:25 UTC |
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| Update Date | 2025-03-21 19:21:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00277063 |
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| Frequency | 7.3 |
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| Structure | |
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| Chemical Formula | C5H9NOS |
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| Molecular Mass | 131.0405 |
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| SMILES | CCOCCN=C=S |
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| InChI Key | CFUAEWAXXXGVBR-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 | dialkyl ethershydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | aliphatic acyclic compoundisothiocyanateetherorganic 1,3-dipolar compounddialkyl etherpropargyl-type 1,3-dipolar organic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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