CAS | 2586-96-1 |
Structure | |
Synonyms | Hiensinine |
IUPAC Name | 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol |
Molecular Weight | 610.74 |
Molecular Formula | C37H42N2O6 |
Canonical SMILES | CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC=C(C=C3)O)OC4=C(C=CC(=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC |
InChI | InChI=1S/C37H42N2O6/c1-38-14-13-26-20-35(43-4)37(22-29(26)30(38)16-23-6-9-27(40)10-7-23)45-33-18-24(8-11-32(33)41)17-31-28-21-36(44-5)34(42-3)19-25(28)12-15-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3/t30-,31-/m1/s1 |
InChI Key | XCUCMLUTCAKSOZ-FIRIVFDPSA-N |
Boiling Point | 722.0±60.0 °C |
Melting Point | 95-99 °C |
Purity | 98% |
Density | 1.218±0.06 g/ml |
pKa | 9.28±0.45 |
Appearance | Powder |
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