| 英文别名 | (3S)-6,7-Dimethoxy-3-[(5R)-4-methoxy-6-(~13~C,~2~H_3_)methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-2-benzofuran-1(3H)-one |
| CAS号 | 1217680-57-3 |
| SMILES | [13C]([2H])([2H])([2H])N1CCC2=CC3=C(C(=C2[C@@H]1[C@@H]4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OC)OCO3
[2H][13C]([2H])([2H])N1CCc2cc3c(c(c2[C@@H]1[C@@H]4c5ccc(c(c5C(=O)O4)OC)OC)OC)OCO3 |
| Inchi | InChI=1S/C22H23NO7/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18/h5-6,9,17-18H,7-8,10H2,1-4H3/t17-,18+/m1/s1/i1+1D3 |
| InchiKey | AKNNEGZIBPJZJG-DSZYONIXSA-N |
| 分子式 Formula | C2113CH20D3NO7 |
| 分子量 Molecular Weight | 417 |
| Polarizability极化度 | 42.2±0.5 10-24cm3 |
| 密度 Density | 1.3±0.1 g/cm3 |
| 储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |
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