5,8,9,10,11,12-Hexahydro-6H-benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine-9,10-diol; (9β,10β)-form, 9-O-(3,4-Dimethoxyphenyl)
AlkaPlorer ID: AK300310
Synonym: Berberine phenoxide
IUPAC Name: None
Structure
SMILES: COC1=CC=C(OC2C3=C(C=C4C5=CC6=C(C=C5CCN4C3)OCO6)CCC2O)C=C1OC
InChI: InChI=1S/C26H27NO6/c1-29-22-6-4-17(11-23(22)30-2)33-26-19-13-27-8-7-16-10-24-25(32-14-31-24)12-18(16)20(27)9-15(19)3-5-21(26)28/h4,6,9-12,21,26,28H,3,5,7-8,13-14H2,1-2H3
InChIKey: HEHNNJQRJIAEKD-UHFFFAOYSA-N
Reference
CAS: 1891024-37-5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Berberis aristata | Berberis | Berberidaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 449.5030000000003
TPSA？: 69.62
MolLogP？: 3.5440000000000023
Number of H-Donors: 1
Number of H-Acceptors: 7
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|