| Name |
Isoscoparin E
(-)-Isoscoparin E |
| Formula |
C22H32O6 |
| Mw |
392.21988875 |
| CAS RN |
1097647-28-3 |
| C_ID |
C00047253
, 
|
| InChIKey |
RMMOXMPERYSBTK-YAYYICLTNA-N |
| InChICode |
InChI=1S/C22H32O6/c1-10-14-15(24)16(25)17-21(5)8-6-7-20(3,4)12(21)9-13(28-11(2)23)22(17,18(10)26)19(14)27/h12-17,19,24-25,27H,1,6-9H2,2-5H3/t12-,13-,14+,15-,16+,17+,19-,21-,22-/m1/s1 |
| SMILES |
[C@@H]1([C@]23[C@@H](C[C@@H]4C(CCC[C@]4([C@@H]2[C@H]([C@@H]([C@@H]1C(=C)C3=O)O)O)C)(C)C)OC(=O)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Isodon scoparius | Ref. |
|
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