10-METHOXY CINCHONAMINE
AlkaPlorer ID: AK493600
Synonym: None
IUPAC Name: 2-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-3-(2-methoxyethyl)-1H-indole
Structure
SMILES: C=C[C@H]1CN2CC[C@H]1C[C@H]2C1=C(CCOC)C2=CC=CC=C2N1
InChI: InChI=1S/C20H26N2O/c1-3-14-13-22-10-8-15(14)12-19(22)20-17(9-11-23-2)16-6-4-5-7-18(16)21-20/h3-7,14-15,19,21H,1,8-13H2,2H3/t14-,15-,19-/m0/s1
InChIKey: PSVGFMRJXAGGQR-DOXZYTNZSA-N
Reference
Investigation of Cinchona leaf alkaloids by high-performance liquid chromatography
PubChem CID: 76326654
LOTUS: LTS0043356
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cinchona pubescens | Cinchona | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 310.441
TPSA？: 28.26
MolLogP？: 3.925700000000002
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Entamoeba histolytica | Entamoeba histolytica | IC50 | 4.5 | ug.mL-1 | 10.1007/s00044-011-9767-1 |