Showing metabocard for Deoxynivalenol-3-sulfate (HMDB0341573)
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| Version | 5.0 | |||||||||||||||
| Status | Expected but not Quantified | |||||||||||||||
| Creation Date | 2025-09-11 15:26:13 UTC | |||||||||||||||
| Update Date | 2025-09-11 15:35:01 UTC | |||||||||||||||
| HMDB ID | HMDB0341573 | |||||||||||||||
| Secondary Accession Numbers | None | |||||||||||||||
| Metabolite Identification | ||||||||||||||||
| Common Name | Deoxynivalenol-3-sulfate | |||||||||||||||
| Description | DON-3-sulfate, also known as DON-3-sulphate, belongs to the class of organic compounds known as trichothecenes. These are sesquiterpene mycotoxins structurally characterized by the presence of an epoxide ring and a benzopyran derivative with a variant number of hydroxyl, acetyl, or other substituents. The most important structural features causing the biological activities of trichothecenes are the 12,13-epoxy ring, the presence of hydroxyl or acetyl groups at appropriate positions on the trichothecene nucleus and the structure and position of the side-chain. Based on a literature review a significant number of articles have been published on DON-3-sulfate. | |||||||||||||||
| Structure |  Structure for HMDB0341573 (Deoxynivalenol-3-sulfate)
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| Synonyms |
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| Chemical Formula | C15H20O9S | |||||||||||||||
| Average Molecular Weight | 376.38 | |||||||||||||||
| Monoisotopic Molecular Weight | 376.082803398 | |||||||||||||||
| IUPAC Name | Not Available | |||||||||||||||
| Traditional Name | Not Available | |||||||||||||||
| CAS Registry Number | Not Available | |||||||||||||||
| SMILES | Not Available | |||||||||||||||
| InChI Identifier | Not Available | |||||||||||||||
| InChI Key | HNLHVHDWMBSDFR-QGRHZQQGSA-N | |||||||||||||||
| Chemical Taxonomy | ||||||||||||||||
| Description | Belongs to the class of organic compounds known as trichothecenes. These are sesquiterpene mycotoxins structurally characterized by the presence of an epoxide ring and a benzopyran derivative with a variant number of hydroxyl, acetyl, or other substituents. The most important structural features causing the biological activities of trichothecenes are the 12,13-epoxy ring, the presence of hydroxyl or acetyl groups at appropriate positions on the trichothecene nucleus and the structure and position of the side-chain. | |||||||||||||||
| Kingdom | Organic compounds | |||||||||||||||
| Super Class | Lipids and lipid-like molecules | |||||||||||||||
| Class | Prenol lipids | |||||||||||||||
| Sub Class | Sesquiterpenoids | |||||||||||||||
| Direct Parent | Trichothecenes | |||||||||||||||
| Alternative Parents | ||||||||||||||||
| Substituents |
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| Molecular Framework | Aliphatic heteropolycyclic compounds | |||||||||||||||
| External Descriptors | Not Available | |||||||||||||||
| Ontology | ||||||||||||||||
| Not Available | Not Available | |||||||||||||||
| Physical Properties | ||||||||||||||||
| State | Not Available | |||||||||||||||
| Experimental Molecular Properties |
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| Experimental Chromatographic Properties | Not Available | |||||||||||||||
| Predicted Molecular Properties | Not Available | |||||||||||||||
| Predicted Chromatographic Properties | Predicted Retention TimesNot AvailablePredicted Kovats Retention IndicesNot Available | |||||||||||||||
| Spectra | ||||||||||||||||
| Biological Properties | ||||||||||||||||
| Cellular Locations | Not Available | |||||||||||||||
| Biospecimen Locations | Not Available | |||||||||||||||
| Tissue Locations | Not Available | |||||||||||||||
| Pathways |
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| Normal Concentrations | ||||||||||||||||
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| Abnormal Concentrations | ||||||||||||||||
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| Associated Disorders and Diseases | ||||||||||||||||
| Disease References | None | |||||||||||||||
| Associated OMIM IDs | None | |||||||||||||||
| External Links | ||||||||||||||||
| DrugBank ID | Not Available | |||||||||||||||
| Phenol Explorer Compound ID | Not Available | |||||||||||||||
| FooDB ID | Not Available | |||||||||||||||
| KNApSAcK ID | Not Available | |||||||||||||||
| Chemspider ID | Not Available | |||||||||||||||
| KEGG Compound ID | Not Available | |||||||||||||||
| BioCyc ID | Not Available | |||||||||||||||
| BiGG ID | Not Available | |||||||||||||||
| Wikipedia Link | Not Available | |||||||||||||||
| METLIN ID | Not Available | |||||||||||||||
| PubChem Compound | 101899454 | |||||||||||||||
| PDB ID | Not Available | |||||||||||||||
| ChEBI ID | 149449 | |||||||||||||||
| Food Biomarker Ontology | Not Available | |||||||||||||||
| VMH ID | Not Available | |||||||||||||||
| MarkerDB ID | Not Available | |||||||||||||||
| Good Scents ID | Not Available | |||||||||||||||
| References | ||||||||||||||||
| Synthesis Reference | Not Available | |||||||||||||||
| Material Safety Data Sheet (MSDS) | Not Available | |||||||||||||||
| General References | Not Available | |||||||||||||||
