Lakshminine
AlkaPlorer ID: AK168060
Synonym: 6-Amino-5-methoxy-7H-dibenzo[de,h]quinolin-7-one
IUPAC Name: 10-amino-11-methoxy-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-8-one
Structure
SMILES: COC1=CC2=CC=NC3=C2C(=C1N)C(=O)C1=C3C=CC=C1
InChI: InChI=1S/C17H12N2O2/c1-21-12-8-9-6-7-19-16-10-4-2-3-5-11(10)17(20)14(13(9)16)15(12)18/h2-8H,18H2,1H3
InChIKey: IHHZBGNIAYEFQG-UHFFFAOYSA-N
Reference
PubChem CID: 11097799
CAS: 479669-27-7
LOTUS: LTS0166722
SuperNatural Ⅲ: SN0145631
NPASS: NPC74575
COCONUT: CNP0263633
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Sciadotenia toxifera | Sciadotenia | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 276.295
TPSA？: 65.21000000000001
MolLogP？: 3.037000000000001
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | AGS | IC50 | 2090.0 | nM | 10.1021/np100370g |
| Homo sapiens | AGS | IC50 | 78600.0 | nM | 10.1016/j.ejmech.2013.01.049 |
| Homo sapiens | J82 | IC50 | 2090.0 | nM | 10.1021/np100370g |
| Homo sapiens | J82 | IC50 | 37600.0 | nM | 10.1016/j.ejmech.2013.01.049 |
| Homo sapiens | MRC5 | IC50 | 17900.0 | nM | 10.1016/j.bmcl.2012.10.092 |
| Homo sapiens | MRC5 | IC50 | 17900.0 | nM | 10.1016/j.ejmech.2013.01.049 |
| Homo sapiens | SK-MES-1 | IC50 | 2090.0 | nM | 10.1021/np100370g |
| Homo sapiens | SK-MES-1 | IC50 | 43300.0 | nM | 10.1016/j.ejmech.2013.01.049 |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 100000.0 | nM | 10.1016/j.bmcl.2012.10.092 |
| None | NON-PROTEIN TARGET | IC50 | 2090.0 | nM | 10.1021/np100370g |
| None | Unchecked | Ratio IC50 | 0.18 | None | 10.1016/j.bmcl.2012.10.092 |