Curacautine; (R)-form, 10-Demethoxy, O12-de-Me
AlkaPlorer ID: AK293345
Synonym: Sindamine
IUPAC Name: 4-[5-[[6,7-dimethoxy-8-[(6-methoxy-2-methyl-1-oxo-3,4-dihydroisoquinolin-7-yl)oxy]-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-hydroxyphenoxy]benzaldehyde
Structure
SMILES: COC1=CC2=C(C=C1OC1=C(OC)C(OC)=CC3=C1C(CC1=CC=C(O)C(OC4=CC=C(C=O)C=C4)=C1)N(C)CC3)C(=O)N(C)CC2
InChI: InChI=1S/C37H38N2O8/c1-38-14-13-25-19-33(44-4)35(45-5)36(47-32-20-27-24(18-31(32)43-3)12-15-39(2)37(27)42)34(25)28(38)16-23-8-11-29(41)30(17-23)46-26-9-6-22(21-40)7-10-26/h6-11,17-21,28,41H,12-16H2,1-5H3
InChIKey: PKCJVBBDONPCNC-UHFFFAOYSA-N
Reference
Gandharamine: A New Benzylisoquinoline Alkaloid from Berberis baluchistanica
PubChem CID: 162975683
LOTUS: LTS0065502
COCONUT: CNP0247531.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Berberis lycium | Berberis | Berberidaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 638.7169999999999
TPSA？: 107.0
MolLogP？: 6.214900000000007
Number of H-Donors: 1
Number of H-Acceptors: 9
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|