| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:50 UTC |
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| Update Date | 2025-03-25 00:46:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02155453 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H9NO4S2 |
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| Molecular Mass | 222.9973 |
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| SMILES | Cc1csc(CCOS(=O)(=O)O)n1 |
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| InChI Key | NNDXSQWGKLPBEW-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 | 2,4-disubstituted thiazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl sulfatesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundssulfuric acid monoesters |
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| Substituents | sulfuric acid monoesterorganic sulfuric acid or derivativesaromatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic oxideorganic oxygen compound2,4-disubstituted 1,3-thiazolealkyl sulfateorganonitrogen compoundorganopnictogen compoundsulfate-esterhydrocarbon derivativeorganic nitrogen compoundsulfuric acid esterorganooxygen compound |
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