| Name |
Scoparic acid A |
| Formula |
C27H36O5 |
| Mw |
440.25627426 |
| CAS RN |
116425-30-0 |
| C_ID |
C00024033
, 
|
| InChIKey |
GIQOHSBJFWWSAH-YNXSAMIGNA-N |
| InChICode |
InChI=1S/C27H36O5/c1-18(13-16-28)11-12-21-19(2)17-22(32-24(29)20-9-6-5-7-10-20)23-26(21,3)14-8-15-27(23,4)25(30)31/h5-7,9-10,13,21-23,28H,2,8,11-12,14-17H2,1,3-4H3,(H,30,31)/b18-13+/t21-,22-,23-,26-,27-/m1/s1 |
| SMILES |
C=C1C[C@@H](OC(=O)c2ccccc2)[C@@H]2[C@](C)(CCC[C@@]2(C)C(=O)O)[C@@H]1CC/C(C)=C/CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Plantaginaceae | Scoparia dulcis L.  | Ref. |
|
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