| Name |
Scopadulin |
| Formula |
C27H36O5 |
| Mw |
440.25627426 |
| CAS RN |
129058-58-8 |
| C_ID |
C00000896
, 
|
| InChIKey |
GXCQICDRLAVBPY-KTFYCXEINA-N |
| InChICode |
InChI=1S/C27H36O5/c1-24(23(29)30)10-7-11-25(2)21(24)20(32-22(28)17-8-5-4-6-9-17)15-18-14-19-16-27(18,25)13-12-26(19,3)31/h4-6,8-9,18-21,31H,7,10-16H2,1-3H3,(H,29,30)/t18-,19-,20-,21+,24-,25+,26-,27+/m1/s1 |
| SMILES |
C[C@@]1(C(=O)O)CCC[C@@]2(C)[C@H]1[C@H](OC(=O)c1ccccc1)C[C@H]1C[C@H]3C[C@@]12CC[C@@]3(C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Plantaginaceae | Scoparia dulcis  | Ref. |
|
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