Jhelumine; O7'-Me
AlkaPlorer ID: AK195120
Synonym: Chenabine
IUPAC Name: 3-[4-[[7-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)oxy]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]-4-hydroxybenzaldehyde
Structure
SMILES: COC1=CC2=C(C=C1OC1=C3CN(C)CCC3=CC(OC)=C1OC)C(CC1=CC=C(OC3=CC(C=O)=CC=C3O)C=C1)N(C)CC2
InChI: InChI=1S/C37H40N2O7/c1-38-14-12-26-19-35(43-4)37(44-5)36(29(26)21-38)46-34-20-28-25(18-33(34)42-3)13-15-39(2)30(28)16-23-6-9-27(10-7-23)45-32-17-24(22-40)8-11-31(32)41/h6-11,17-20,22,30,41H,12-16,21H2,1-5H3
InChIKey: YNXVQRIVDJCIEA-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Berberis lycium | Berberis | Berberidaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 624.7340000000002
TPSA？: 89.93
MolLogP？: 6.574700000000009
Number of H-Donors: 1
Number of H-Acceptors: 9
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|