Details of Marrubiin
| IUPAC | (1R,4S,8S,9R,10R,12R)-9-[2-(furan-3-yl)ethyl]-9-hydroxy-4,8,10-trimethyl-2-oxatricyclo[6.3.1.04,12]dodecan-3-one |
| Canonical Smiles | C[C@@H]1C[C@@H]2[C@H]3[C@](CCC[C@@]3([C@]1(CCC4=COC=C4)O)C)(C(=O)O2)C |
| Inchi | HQLLRHCTVDVUJB-OBHOOXMTSA-N |
| PubChem ID | 73401 |
| Smiles | C[C@@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@@](C)([C@@H]23)[C@@]1(O)CCc1ccoc1 |
| Class | Labdane diterpenoids |
| Super Class | Diterpenoids |
| Pathways | Terpenoids |