| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:48:10 UTC |
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| Update Date | 2025-03-24 17:58:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01029797 |
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| Frequency | 1.4 |
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| Structure | |
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| Chemical Formula | C27H46N2O36S5 |
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| Molecular Mass | 1134.0434 |
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| SMILES | COC1OC(COS(=O)(=O)O)C(OC2OC(COS(=O)(=O)O)C(OC3OC(C(=O)O)C(O)C(O)C3OS(=O)(=O)O)C(OC3OC(COS(=O)(=O)O)CC(O)C3NC(C)=O)C2O)C(O)C1NOS(=O)(=O)O |
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| InChI Key | FOAZDXZMVBBPRA-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 | o-glucuronides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetalsacetamidesalkyl sulfatesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsglucuronic acid derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanespyran carboxylic acidssecondary alcoholssecondary carboxylic acid amidessulfuric acid monoesters |
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| Substituents | sulfuric acid monoestercarbonyl groupcarboxylic acido-glucuronidemonosaccharidecarboxylic acid derivativepyran carboxylic acid1-o-glucuronidebeta-hydroxy acidorganic oxideacetalalkyl sulfatealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneorganoheterocyclic compoundacetamidealcoholpyran carboxylic acid or derivativesorganic sulfuric acid or derivativeshydroxy acidcarboxamide groupoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativespyransecondary alcoholsulfate-esterhydrocarbon derivativeorganic nitrogen compoundsulfuric acid ester |
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