1,2-bis(1H-indol-3-yl)ethane-1,2-dione
AlkaPlorer ID: AK000375
Synonym: None
IUPAC Name: 1,2-bis(1H-indol-3-yl)ethane-1,2-dione
Structure
SMILES: C1=CC=C2C(=C1)C(=CN2)C(=O)C(=O)C3=CNC4=CC=CC=C43
InChI: InChI=1S/C18H12N2O2/c21-17(13-9-19-15-7-3-1-5-11(13)15)18(22)14-10-20-16-8-4-2-6-12(14)16/h1-10,19-20H
InChIKey: VOUJHLROTVTYMT-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fusarium sp. | Fusarium | Nectriaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 288.306
TPSA？: 65.72
MolLogP？: 3.714800000000001
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Staphylococcus aureus (strain MRSA252) | Pyruvate kinase | IC50 | 50200.0 | nM | 10.1016/j.bmcl.2014.09.010 |
| Zika virus | Zika virus | EC50 | 4200.0 | nM | 10.1016/j.bmc.2021.116366 |
| Zika virus | Zika virus | EC50 | 5000.0 | nM | 10.1021/acs.jnatprod.0c00717 |