| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:52:04 UTC |
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| Update Date | 2025-03-21 18:03:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00043515 |
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| Frequency | 78.1 |
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| Structure | |
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| Chemical Formula | C10H9NOS |
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| Molecular Mass | 191.0405 |
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| SMILES | O=C(C1=NCCS1)c1ccccc1 |
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| InChI Key | NBYONMRIOBHNMW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzoyl derivatives |
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| Direct Parent | benzoyl derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl ketonesazacyclic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundsthiazolines |
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| Substituents | meta-thiazolinearomatic heteromonocyclic compoundazacyclebenzoylorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundketoneorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundaryl ketone |
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