Secoquettamine
AlkaPlorer ID: AK251779
Synonym: 4-[4-[2-(Dimethylamino)ethyl]-7-methoxy-2-benzofuranyl]phenol, 4-(2-Dimethylaminoethyl)-2-(4-hydroxyphenyl)-7-methoxybenzofuran
IUPAC Name: 4-[4-[2-(dimethylamino)ethyl]-7-methoxy-1-benzofuran-2-yl]phenol
Structure
SMILES: COC1=CC=C(CCN(C)C)C2=C1OC(C1=CC=C(O)C=C1)=C2
InChI: InChI=1S/C19H21NO3/c1-20(2)11-10-13-6-9-17(22-3)19-16(13)12-18(23-19)14-4-7-15(21)8-5-14/h4-9,12,21H,10-11H2,1-3H3
InChIKey: LPURKHNWTXTKAJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Berberis | Berberidaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Berberis | Berberidaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 311.381
TPSA？: 45.84
MolLogP？: 3.9181000000000026
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|