| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:50:17 UTC |
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| Update Date | 2025-03-24 20:55:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01610014 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C5H5NOS |
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| Molecular Mass | 127.0092 |
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| SMILES | CC(=O)C=CN=C=S |
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| InChI Key | FGPIRSYXHXKMHD-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 | acryloyl compounds |
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| Direct Parent | acryloyl compounds |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | enoneshydrocarbon derivativesisothiocyanatesketonesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | aliphatic acyclic compoundisothiocyanatecarbonyl grouporganic 1,3-dipolar compoundalpha,beta-unsaturated ketoneorganosulfur compoundpropargyl-type 1,3-dipolar organic compoundketoneorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeacryloyl-grouporganic nitrogen compoundenone |
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