(1S)-7-(2-{[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl}-4,5-dimethoxyphenoxy)-1-[(3,4-dimethoxyphenyl)methyl]-5,6-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline
AlkaPlorer ID: AK111771
Synonym: None
IUPAC Name: (1S)-7-[2-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-4,5-dimethoxyphenoxy]-1-[(3,4-dimethoxyphenyl)methyl]-5,6-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline
Structure
SMILES: COC1=CC=C(C[C@H]2C3=C(CCN2C)C(OC)=C(OC)C(OC2=CC(OC)=C(OC)C=C2C[C@@H]2C4=CC(OC)=C(OC)C=C4CCN2C)=C3)C=C1OC
InChI: InChI=1S/C42H52N2O9/c1-43-15-13-26-20-36(47-5)38(49-7)22-29(26)32(43)19-27-21-37(48-6)39(50-8)24-34(27)53-40-23-30-28(41(51-9)42(40)52-10)14-16-44(2)31(30)17-25-11-12-33(45-3)35(18-25)46-4/h11-12,18,20-24,31-32H,13-17,19H2,1-10H3/t31-,32+/m0/s1
InChIKey: LVHZGOYYBUZOMS-AJQTZOPKSA-N
Reference
Alkaloids from Isopyrum thalictroides*1
PubChem CID: 162860215
LOTUS: LTS0054965
SuperNatural Ⅲ: SN0216399-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Isopyrum thalictroides | Isopyrum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 728.8829999999999
TPSA？: 89.55000000000001
MolLogP？: 7.091100000000009
Number of H-Donors: 0
Number of H-Acceptors: 11
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|