| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:30:41 UTC |
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| Update Date | 2025-03-21 18:41:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00135607 |
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| Frequency | 18.5 |
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| Structure | |
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| Chemical Formula | C11H19NO2S |
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| Molecular Mass | 229.1136 |
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| SMILES | O=C(O)CCCCC1SCN2CCCC12 |
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| InChI Key | UXDZTSXOBXROHV-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 | pyrrolothiazoles |
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| Subclass | pyrrolothiazoles |
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| Direct Parent | pyrrolothiazoles |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsdialkylthioethersheterocyclic fatty acidshydrocarbon derivativesmedium-chain fatty acidsmonocarboxylic acids and derivativesn-alkylpyrrolidinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolesthiazolidinesthiohemiaminal derivatives |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidheterocyclic fatty acidfatty acidcarboxylic acid derivativealiphatic heteropolycyclic compoundorganic oxideorganonitrogen compoundhemithioaminalorganopnictogen compoundmedium-chain fatty acidpyrrolidineazacyclen-alkylpyrrolidinepyrrolothiazoledialkylthioethermonocarboxylic acid or derivativesorganic oxygen compoundthioetherpyrrolehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundthiazolidine |
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