| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:39:26 UTC |
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| Update Date | 2025-03-24 20:50:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01585133 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C42H71N3O37S2 |
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| Molecular Mass | 1273.3208 |
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| SMILES | CC(=O)NC1C(OCC2OC(OC3C(COS(=O)(=O)O)OC(OC4C(O)C(COS(=O)(=O)O)OC(OC(C(O)CO)C(O)C(O)C=O)C4O)C(NC(C)=O)C3O)C(O)C(OC3OC(CO)C(O)C(O)C3NC(C)=O)C2O)OC(CO)C(O)C1O |
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| InChI Key | XPLGGRBYPNLWHS-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 | n-acyl-alpha-hexosamines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetalsacetamidesalkyl glycosidesalkyl sulfatesalpha-hydroxyaldehydesbeta-hydroxy aldehydescarboxylic acids and derivativesfatty acyl glycosides of mono- and disaccharideshydrocarbon derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcoholssecondary carboxylic acid amidessulfuric acid monoesters |
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| Substituents | fatty acylfatty acyl glycoside of mono- or disaccharidebeta-hydroxy aldehydesulfuric acid monoestercarbonyl groupmonosaccharidecarboxylic acid derivativen-acyl-alpha-hexosamineorganic oxidealpha-hydroxyaldehydeacetalalkyl sulfatealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholorganoheterocyclic compoundacetamidealcoholorganic sulfuric acid or derivativesfatty acyl glycosidealdehydecarboxamide groupoxacyclesecondary carboxylic acid amidesecondary alcoholsulfate-esterhydrocarbon derivativeorganic nitrogen compoundsulfuric acid esteralkyl glycoside |
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