Lepidiline A
AlkaPlorer ID: AK006458
Synonym: None
IUPAC Name: 1,3-dibenzyl-4,5-dimethylimidazol-1-ium;chloride
Structure
SMILES: CC1=C([N+](=CN1CC2=CC=CC=C2)CC3=CC=CC=C3)C.[Cl-]
InChI: InChI=1S/C19H21N2.ClH/c1-16-17(2)21(14-19-11-7-4-8-12-19)15-20(16)13-18-9-5-3-6-10-18;/h3-12,15H,13-14H2,1-2H3;1H/q+1;/p-1
InChIKey: ZATWGHMQWRXUNZ-UHFFFAOYSA-M
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lepidium meyenii | Lepidium | Brassicaceae | Brassicales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 312.84400000000005
TPSA？: 8.809999999999999
MolLogP？: 0.49304000000000037
Number of H-Donors: 0
Number of H-Acceptors: 1
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A549 | ED50 | 10.0 | ug ml-1 | 10.1021/np030031i |
| Homo sapiens | HL-60 | IC50 | 32300.0 | nM | 10.1021/acs.jnatprod.1c00797 |
| Homo sapiens | HT-29 | ED50 | 10.0 | ug ml-1 | 10.1021/np030031i |
| Homo sapiens | HUVEC | IC50 | 100000.0 | nM | 10.1021/acs.jnatprod.1c00797 |
| Homo sapiens | MCF7 | IC50 | 100000.0 | nM | 10.1021/acs.jnatprod.1c00797 |
| Homo sapiens | MIA PaCa-2 | ED50 | 10.0 | ug ml-1 | 10.1021/np030031i |
| Homo sapiens | PC-3 | ED50 | 10.0 | ug ml-1 | 10.1021/np030031i |
| Homo sapiens | UMUC3 | ED50 | 10.0 | ug ml-1 | 10.1021/np030031i |
| None | NON-PROTEIN TARGET | ED50 | 7.39 | ug ml-1 | 10.1021/np030031i |
| None | NON-PROTEIN TARGET | ED50 | 10.0 | ug ml-1 | 10.1021/np030031i |