| 名称 | 内容 |
|---|---|
| kegg编号 | C09128 |
| pubchemid | 11320 |
| name | Marrubiin |
| formula | C20H28O4 |
| structure |  |
| Isomeric_Smiles | C=CC1CN2CCC1CC2[C@@H](C3=CC=NC4=CC=CC=C34)O |
| Cannoical_Smiles | C=CC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O |
| Gotenzyme_Smiles | C[C@@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@@](C)([C@@H]23)[C@@]1(O)CCc1ccoc1 |
