| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:57:05 UTC |
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| Update Date | 2025-03-25 00:52:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02194530 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H36O9S |
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| Molecular Mass | 428.208 |
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| SMILES | CCCCCCCCCCCCOC1OC(COS(=O)(=O)O)C(O)C(O)C1O |
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| InChI Key | GMQJIRLCVBTXKU-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acyl glycosides |
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| Direct Parent | fatty acyl glycosides of mono- and disaccharides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetalsalkyl glycosidesalkyl sulfateshydrocarbon derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanessecondary alcoholssulfuric acid monoesters |
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| Substituents | alcoholfatty acyl glycoside of mono- or disaccharidesulfuric acid monoesterorganic sulfuric acid or derivativesmonosaccharideoxacyclesaccharideorganic oxideorganic oxygen compoundacetalalkyl sulfatealiphatic heteromonocyclic compoundsecondary alcoholsulfate-esterhydrocarbon derivativeoxanesulfuric acid esterorganoheterocyclic compoundorganooxygen compoundalkyl glycoside |
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