11-Methoxysampangine
AlkaPlorer ID: AK049821
Synonym: '11-Methoxy-7H-naphtho1,2,3-ij2,7naphthyridin-7-one', '11-methoxysampangine'
IUPAC Name: 3-methoxy-10,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-8-one
Structure
SMILES: COC1=CC=CC2=C1C1=NC=CC3=CC=NC(=C13)C2=O
InChI: InChI=1S/C16H10N2O2/c1-20-11-4-2-3-10-13(11)14-12-9(5-7-17-14)6-8-18-15(12)16(10)19/h2-8H,1H3
InChIKey: ZLDFQCLGYOKBIH-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ambavia gerrardii | Ambavia | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 262.268
TPSA？: 52.080000000000005
MolLogP？: 2.849800000000001
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A2780 | IC50 | 10300.0 | nM | 10.1021/np200093n |
| Homo sapiens | NCI-H460 | IC50 | 570.0 | nM | 10.1021/np200093n |