Akagerine Lactone
AlkaPlorer ID: AK148818
Synonym: None
IUPAC Name: 4-[(5S,7R,9S)-9-hydroxy-4-methyl-4,10-diazatetracyclo[8.6.1.05,17.011,16]heptadeca-11,13,15-trien-7-yl]-2H-furan-5-one
Structure
SMILES: CN1CCC2C3=CC=CC=C3N3C2[C@@H]1C[C@@H](C1=CCOC1=O)C[C@@H]3O
InChI: InChI=1S/C20H24N2O3/c1-21-8-6-15-14-4-2-3-5-16(14)22-18(23)11-12(10-17(21)19(15)22)13-7-9-25-20(13)24/h2-5,7,12,15,17-19,23H,6,8-11H2,1H3/t12-,15?,17+,18+,19?/m1/s1
InChIKey: ZKIUNXNZAGMWLK-CXKFYANOSA-N
Reference
Antiplasmodial Activity of Alkaloids from Various <i>Strychnos</i> Species
PubChem CID: 44559926
LOTUS: LTS0239575
NPASS: NPC474058
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Strychnos johnsonii | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 340.42300000000006
TPSA？: 53.010000000000005
MolLogP？: 1.8745
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 17000.0 | nM | 10.1021/np020070e |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 25900.0 | nM | 10.1021/np020070e |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 27500.0 | nM | 10.1021/np020070e |
| Plasmodium falciparum | Plasmodium falciparum | IC90 | 53300.0 | nM | 10.1021/np020070e |
| Plasmodium falciparum | Plasmodium falciparum | IC90 | 55200.0 | nM | 10.1021/np020070e |
| Plasmodium falciparum | Plasmodium falciparum | IC90 | 60700.0 | nM | 10.1021/np020070e |