| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:33 UTC |
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| Update Date | 2025-03-25 00:47:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161417 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H17NO6S |
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| Molecular Mass | 267.0777 |
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| SMILES | NCCSCC1(O)OC(CO)C(O)C(O)C1=O |
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| InChI Key | YSHDTRKLFPIXDB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | monosaccharides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acyloinscyclic ketonesdialkylthioethershemiacetalshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcoholssulfenyl compounds |
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| Substituents | carbonyl groupmonosaccharidecyclic ketoneorganosulfur compoundketoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhemiacetaloxaneprimary alcoholorganoheterocyclic compoundalcoholsulfenyl compounddialkylthioetheroxacyclethioetheracyloinsecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
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