N-Methyl-7-epi-dioncophylline A
AlkaPlorer ID: AK013929
Synonym: '', 'N-Methyldioncophylline A', 'N-Methyl-7-epi-dioncophylline A', 'N-Methyltriphyophylline'
IUPAC Name: (1R,3R)-7-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-8-ol
Structure
SMILES: COC1=CC=CC2=C(C3=CC=C4C[C@@H](C)N(C)[C@H](C)C4=C3O)C(C)=CC(OC)=C12
InChI: InChI=1S/C25H29NO3/c1-14-12-21(29-6)24-18(8-7-9-20(24)28-5)22(14)19-11-10-17-13-15(2)26(4)16(3)23(17)25(19)27/h7-12,15-16,27H,13H2,1-6H3/t15-,16-/m1/s1
InChIKey: ZSYADESMHZOJRK-HZPDHXFCSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ancistrocladus abbreviatus | Ancistrocladus | Ancistrocladaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 391.5110000000002
TPSA?: 41.93000000000001
MolLogP?: 5.475420000000006
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Spodoptera littoralis | Spodoptera littoralis | EC50 | 377.0 | ug | 10.1021/np960707s |
