6-Bromo-2-(methylthio)-3H-indol-3-one
AlkaPlorer ID: AK252796
Synonym: Tyrindoleninone
IUPAC Name: 6-bromo-2-methylsulfanylindol-3-one
Structure
SMILES: CSC1=NC2=CC(Br)=CC=C2C1=O
InChI: InChI=1S/C9H6BrNOS/c1-13-9-8(12)6-3-2-5(10)4-7(6)11-9/h2-4H,1H3
InChIKey: FGSMWRIKDCAOHH-UHFFFAOYSA-N
Reference
Natural Product Research in the Australian Marine Invertebrate Dicathais orbita
PubChem CID: 618037
CAS: 50630-70-1
LOTUS: LTS0141905
SuperNatural Ⅲ: SN0085287
COCONUT: CNP0231924
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Agnewia tritoniformis | Agnewia | Muricidae | Neogastropoda | Gastropoda | Mollusca | Metazoa | Eukaryota |
| None | Morula | Muricidae | Neogastropoda | Gastropoda | Mollusca | Metazoa | Eukaryota |
| None | Thais | Muricidae | Neogastropoda | Gastropoda | Mollusca | Metazoa | Eukaryota |
| Nucella lapillus | Nucella | Muricidae | Neogastropoda | Gastropoda | Mollusca | Metazoa | Eukaryota |
| Dicathais orbita | Dicathais | Muricidae | Neogastropoda | Gastropoda | Mollusca | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 256.124
TPSA？: 29.43
MolLogP？: 3.038400000000001
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|