| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:41:01 UTC |
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| Update Date | 2025-03-21 17:58:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00017583 |
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| Frequency | 239.1 |
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| Structure | |
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| Chemical Formula | C6H9NO4S |
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| Molecular Mass | 191.0252 |
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| SMILES | OCC1OC(N=C=S)C(O)C1O |
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| InChI Key | WZGNUGQMDKVJOC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | monosaccharides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativesisothiocyanatesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholspropargyl-type 1,3-dipolar organic compoundssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholisothiocyanatetetrahydrofuranmonosaccharideorganic 1,3-dipolar compoundorganosulfur compoundpropargyl-type 1,3-dipolar organic compoundoxacyclealiphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholorganoheterocyclic compound |
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