"Cuspanine
AlkaPlorer ID: AK026525
Synonym: None
IUPAC Name: 1-hydroxy-2,3,5,6-tetramethoxy-10H-acridin-9-one
Structure
SMILES: COC1=C(OC)C(O)=C2C(=O)C3=CC=C(OC)C(OC)=C3NC2=C1
InChI: InChI=1S/C17H17NO6/c1-21-10-6-5-8-13(16(10)23-3)18-9-7-11(22-2)17(24-4)15(20)12(9)14(8)19/h5-7,20H,1-4H3,(H,18,19)
InChIKey: AJRHMDUHBMQVJL-UHFFFAOYSA-N
Reference
Molluscicidal Acridone Alkaloids from Angostura paniculata: Isolation, Structures, and Synthesis
PubChem CID: 44584643
LOTUS: LTS0246400
COCONUT: CNP0080584
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 331.324
TPSA？: 90.00999999999999
MolLogP？: 2.4213
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Biomphalaria glabrata | Biomphalaria glabrata | LC50 | 5.0 | ppm | 10.1021/np50086a012 |
| Homo sapiens | BT-20 | GI | nan | None | 10.1021/np50086a012 |
| Homo sapiens | HeLa | IC50 | 2.5 | ug.mL-1 | 10.1021/np50086a012 |