None
AlkaPlorer ID: AK324693
Synonym: None
IUPAC Name: 1,4-bis(3,4-dimethoxyphenyl)-N-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]butan-2-amine
Structure
SMILES: COC1=CC=C(CCC(CC2=CC=C(OC)C(OC)=C2)NCCC2=CC(OC)=C3OCOC3=C2)C=C1OC
InChI: InChI=1S/C30H37NO7/c1-32-24-10-7-20(15-26(24)34-3)6-9-23(14-21-8-11-25(33-2)27(16-21)35-4)31-13-12-22-17-28(36-5)30-29(18-22)37-19-38-30/h7-8,10-11,15-18,23,31H,6,9,12-14,19H2,1-5H3
InChIKey: LDVSZWBQDOPRJF-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ficus schwarzii | Ficus | Moraceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 523.6260000000003
TPSA？: 76.64000000000001
MolLogP？: 4.834500000000005
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Rattus norvegicus | Aorta | Activity | nan | None | 10.1021/acs.jnatprod.9b01160 |
| Rattus norvegicus | Aorta | EC50 | 2100.0 | nM | 10.1021/acs.jnatprod.9b01160 |
| Rattus norvegicus | Aorta | Emax | 116.1 | % | 10.1021/acs.jnatprod.9b01160 |