Rugosinone; 3,4-Dihydro
AlkaPlorer ID: AK069714
Synonym: Dihydrorugosinone, Dihydrolinaresine
IUPAC Name: 7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl-(2-hydroxy-3,4-dimethoxyphenyl)methanone
Structure
SMILES: COC1=CC=C(C(=O)C2=NCCC3=CC4=C(C=C23)OCO4)C(O)=C1OC
InChI: InChI=1S/C19H17NO6/c1-23-13-4-3-11(18(22)19(13)24-2)17(21)16-12-8-15-14(25-9-26-15)7-10(12)5-6-20-16/h3-4,7-8,22H,5-6,9H2,1-2H3
InChIKey: WTHZSAUEBXLXHB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Berberis valdiviana | Berberis | Berberidaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Berberis darwinii | Berberis | Berberidaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 355.3460000000001
TPSA？: 86.58000000000001
MolLogP？: 2.3662
Number of H-Donors: 1
Number of H-Acceptors: 7
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|