None
AlkaPlorer ID: AK323627
Synonym: None
IUPAC Name: (13aS)-9,10-dihydroxy-2,3,4-trimethoxy-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one
Structure
SMILES: COC1=CC2=C(CCN3C(=O)C4=C(O)C(O)=CC=C4C[C@@H]23)C(OC)=C1OC
InChI: InChI=1S/C20H21NO6/c1-25-15-9-12-11(18(26-2)19(15)27-3)6-7-21-13(12)8-10-4-5-14(22)17(23)16(10)20(21)24/h4-5,9,13,22-23H,6-8H2,1-3H3/t13-/m0/s1
InChIKey: VKUWPUZYZWALRN-ZDUSSCGKSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Miliusa cuneata | Miliusa | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 371.3890000000002
TPSA？: 88.46000000000001
MolLogP？: 2.4193000000000007
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Chlorocebus sabaeus | Vero | IC50 | 47800.0 | nM | 10.1021/acs.jnatprod.5b01054 |
| Homo sapiens | KB | IC50 | 47800.0 | nM | 10.1021/acs.jnatprod.5b01054 |
| Mus musculus | RAW264.7 | Inhibition | nan | % | 10.1016/j.bmc.2020.115462 |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 29100.0 | nM | 10.1021/acs.jnatprod.5b01054 |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 47800.0 | nM | 10.1021/acs.jnatprod.5b01054 |
| None | Unchecked | IC50 | 11300.0 | nM | 10.1016/j.bmc.2020.115462 |