Ancistrocongoline D
AlkaPlorer ID: AK010506
Synonym: None
IUPAC Name: (1R,3R)-7-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-8-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-6-ol
Structure
SMILES: COC1=C2C(=CC(O)=C1C1=C(C)C=C(OC)C3=C1C=CC=C3OC)C[C@@H](C)N[C@@H]2C
InChI: InChI=1S/C25H29NO4/c1-13-10-20(29-5)23-17(8-7-9-19(23)28-4)21(13)24-18(27)12-16-11-14(2)26-15(3)22(16)25(24)30-6/h7-10,12,14-15,26-27H,11H2,1-6H3/t14-,15-/m1/s1
InChIKey: RPYYNECGOSGRFR-HUUCEWRRSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ancistrocladus congolensis | Ancistrocladus | Ancistrocladaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 407.5100000000001
TPSA？: 59.95
MolLogP？: 5.1418200000000045
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Leishmania donovani | Leishmania donovani | IC50 | 30.0 | ug.mL-1 | 10.1021/np010622d |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 1.983 | ug.mL-1 | 10.1021/np010622d |
| Rattus norvegicus | L6 | MIC | 27.7 | ug.mL-1 | 10.1021/np010622d |
| Trypanosoma brucei rhodesiense | Trypanosoma brucei rhodesiense | IC50 | 5.86 | ug.mL-1 | 10.1021/np010622d |
| Trypanosoma cruzi | Trypanosoma cruzi | IC50 | 30.1 | ug.mL-1 | 10.1021/np010622d |