| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:08 UTC |
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| Update Date | 2025-03-25 00:59:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02238152 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H17NO4S |
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| Molecular Mass | 247.0878 |
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| SMILES | O=C(O)CCCC1N2CCCC2CS1(=O)=O |
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| InChI Key | KKPHSVIFNXKVIA-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 acidsheterocyclic fatty acidshydrocarbon derivativesmonocarboxylic acids and derivativesn-alkylpyrrolidinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolessulfonesthiazolidines |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidazacyclen-alkylpyrrolidineheterocyclic fatty acidpyrrolothiazolefatty acidcarboxylic acid derivativealiphatic heteropolycyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineorganooxygen compoundsulfonethiazolidine |
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