Dioncophylline A; 3-Epimer
AlkaPlorer ID: AK296705
Synonym: Isotriphyophylline
IUPAC Name: 7-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol
Structure
SMILES: COC1=CC=CC2=C(C3=CC=C4CC(C)NC(C)C4=C3O)C(C)=CC(OC)=C12
InChI: InChI=1S/C24H27NO3/c1-13-11-20(28-5)23-17(7-6-8-19(23)27-4)21(13)18-10-9-16-12-14(2)25-15(3)22(16)24(18)26/h6-11,14-15,25-26H,12H2,1-5H3
InChIKey: MXIZZLBQRBAZEX-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Dioncophyllum thollonii | Dioncophyllum | Dioncophyllaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 377.48400000000015
TPSA？: 50.72
MolLogP？: 5.133220000000005
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|