| Name |
Marrulibanoside |
| Formula |
C20H28O5 |
| Mw |
348.193674 |
| CAS RN |
72009-99-5 |
| C_ID |
C00041663
, 
|
| InChIKey |
MJNZFQTXIXWYBH-IFSVKLSWNA-N |
| InChICode |
InChI=1S/C20H28O5/c1-12-9-14-16-18(2,17(22)25-14)6-4-7-19(16,3)20(12,23)8-5-13-10-15(21)24-11-13/h10,12,14,16,23H,4-9,11H2,1-3H3/t12-,14-,16+,18+,19+,20-/m1/s1 |
| SMILES |
C[C@@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@@](C)([C@@H]23)[C@@]1(O)CCC1=CC(=O)OC1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Marrubium globosum ssp.libanoticum | Ref. |
|
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