Scorpinone
AlkaPlorer ID: AK038357
Synonym: '', 'Scorpinone'
IUPAC Name: 7,9-dimethoxy-3-methylbenzo[g]isoquinoline-5,10-dione
Structure
SMILES: COC1=CC(OC)=C2C(=O)C3=CN=C(C)C=C3C(=O)C2=C1
InChI: InChI=1S/C16H13NO4/c1-8-4-10-12(7-17-8)16(19)14-11(15(10)18)5-9(20-2)6-13(14)21-3/h4-7H,1-3H3
InChIKey: ZEJGLXXBAAPUPK-UHFFFAOYSA-N
Reference
PubChem CID: 11000531
CAS: 77794-86-6
LOTUS: LTS0269242
SuperNatural Ⅲ: SN0468148
COCONUT: CNP0306283
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Amorosia littoralis | Amorosia | Amorosiaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 283.283
TPSA？: 65.49000000000001
MolLogP？: 2.18262
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | PC-3M | Inhibition | None | % | 10.1021/np900684v |
| None | NON-PROTEIN TARGET | Inhibition | None | % | 10.1021/np900684v |