| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:17 UTC |
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| Update Date | 2025-03-25 00:50:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02181455 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H17NO3S |
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| Molecular Mass | 243.0929 |
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| SMILES | O=C(O)CCCCC1SC2CCCN2C1=O |
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| InChI Key | FTKYALAQJZKDHC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | medium-chain fatty acids |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsdialkylthioethersheterocyclic fatty acidshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolidinestertiary carboxylic acid amidesthiazolidinesthiohemiaminal derivatives |
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| Substituents | carbonyl grouplactamcarboxylic acidheterocyclic fatty acidcarboxylic acid derivativealiphatic heteropolycyclic compoundorganic oxidetertiary carboxylic acid amideorganonitrogen compoundhemithioaminalorganopnictogen compoundmedium-chain fatty acidpyrrolidineorganoheterocyclic compoundazacycledialkylthioethercarboxamide groupmonocarboxylic acid or derivativesorganic oxygen compoundthioetherhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundthiazolidine |
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