Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 11:15:10 UTC |
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Update Date | 2025-03-24 21:05:49 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01670436 |
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Frequency | 0.7 |
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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 | O=CCc1nccs1 |
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InChI Key | QBKSVBRTBPDFHO-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organoheterocyclic compounds |
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Class | azoles |
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Subclass | thiazoles |
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Direct Parent | thiazoles |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | alpha-hydrogen aldehydesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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Substituents | carbonyl grouparomatic heteromonocyclic compoundazacycleheteroaromatic compoundaldehydeorganic oxideorganic oxygen compoundalpha-hydrogen aldehydeorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundthiazoleorganooxygen compound |
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