6-O-Methylhamatinine
AlkaPlorer ID: AK010579
Synonym: '', 'O-Methylancistrocladinine'
IUPAC Name: (3S)-5-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydroisoquinoline
Structure
SMILES: COC1=CC(OC)=C(C2=C(C)C=C(OC)C3=C(OC)C=CC=C23)C2=C1C(C)=N[C@@H](C)C2
InChI: InChI=1S/C26H29NO4/c1-14-11-20(29-5)25-17(9-8-10-19(25)28-4)23(14)26-18-12-15(2)27-16(3)24(18)21(30-6)13-22(26)31-7/h8-11,13,15H,12H2,1-7H3/t15-/m0/s1
InChIKey: XSHYHGPIMCKDFK-HNNXBMFYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ancistrocladus tanzaniensis | Ancistrocladus | Ancistrocladaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Cyclea racemosa | Cyclea | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 419.5210000000002
TPSA？: 49.28
MolLogP？: 5.603220000000007
Number of H-Donors: 0
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/np0340549 |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 2.2 | ug.mL-1 | 10.1021/np0340549 |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 5.4 | ug.mL-1 | 10.1021/np0340549 |
| Rattus norvegicus | L6 | MIC | 90.0 | ug.mL-1 | 10.1021/np0340549 |
| Trypanosoma brucei rhodesiense | Trypanosoma brucei rhodesiense | IC50 | 5.2 | ug.mL-1 | 10.1021/np0340549 |
| Trypanosoma cruzi | Trypanosoma cruzi | IC50 | 60.5 | ug.mL-1 | 10.1021/np0340549 |