8-O-isopropyldioncophylline A
AlkaPlorer ID: AK000183
Synonym: None
IUPAC Name: (1R,3R)-7-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-1,3-dimethyl-8-propan-2-yloxy-1,2,3,4-tetrahydroisoquinoline
Structure
SMILES: C[C@@H]1CC2=C([C@H](N1)C)C(=C(C=C2)C3=C4C=CC=C(C4=C(C=C3C)OC)OC)OC(C)C
InChI: InChI=1S/C27H33NO3/c1-15(2)31-27-21(12-11-19-14-17(4)28-18(5)25(19)27)24-16(3)13-23(30-7)26-20(24)9-8-10-22(26)29-6/h8-13,15,17-18,28H,14H2,1-7H3/t17-,18-/m1/s1
InChIKey: GEUZWASUMSPZGV-QZTJIDSGSA-N
Reference
PubChem CID: 10669764
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 419.5650000000002
TPSA？: 39.72
MolLogP？: 6.214820000000007
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 | 94.1 | ug | 10.1021/np960707s |