Structure and Physico-chemical Properties
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Molecular properties generated using the CDK |
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Ligand Activity Visualisation Charts
These are box plot that provide a unique visualisation, summarising all the activity data for a ligand taken from ChEMBL and GtoPdb across multiple targets and species. Click on a plot to see the median, interquartile range, low and high data points. A value of zero indicates that no data are available. A separate chart is created for each target, and where possible the algorithm tries to merge ChEMBL and GtoPdb targets by matching them on name and UniProt accession, for each available species. However, please note that inconsistency in naming of targets may lead to data for the same target being reported across multiple charts.
✖Classification  |
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| Compound class | Natural product or derivative |
| IUPAC Name |
| (3R,5aS,6S,10aR)-6-hydroxy-3-(hydroxymethyl)-2-methyl-3,10a-bis(methylsulfanyl)-1H,2H,3H,4H,5aH,6H,10H,10aH-piperazino[1,2-a]indole-1,4-dione |
| Synonyms |
| AC1L4YI4 | bis(methylthio)gliotoxin | dimethylgliotoxin | FR 49175 |
| Comments |
| FR-49175 is a toxic metabolite with anthiphagocytic and immunosuppressive properties synthesised by fungi such as Aspergillus fumigatus. It is an analog of a gliotoxin known to inhibit PAF-induced platelet aggregation. |
| Database Links |
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| CAS Registry No. | 74149-38-5 (source: Scifinder) |
| ChEMBL Ligand | CHEMBL1088981 |
| GtoPdb PubChem SID | 178100262 |
| PubChem CID | 194564 |
| Search Google for chemical match using the InChIKey | OVBAGMZLGLXSBN-UOVKNHIHSA-N |
| Search Google for chemicals with the same backbone | OVBAGMZLGLXSBN |
| Search UniChem for chemical match using the InChIKey | OVBAGMZLGLXSBN-UOVKNHIHSA-N |
| Search UniChem for chemicals with the same backbone | OVBAGMZLGLXSBN |
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