| Name |
12-Acetoxyhawtriwaic acid. |
| Formula |
C22H28O5 |
| Mw |
372.193674 |
| CAS RN |
172548-61-7 |
| C_ID |
C00054227
|
| InChIKey |
DZAYTXGDCMMRGZ-AZTVTNDUSA-N |
| InChICode |
InChI=1S/C22H28O5/c1-14-7-9-22-13-26-20(24)17(22)5-4-6-19(22)21(14,3)11-18(27-15(2)23)16-8-10-25-12-16/h5,8,10,12,14,18-19H,4,6-7,9,11,13H2,1-3H3/t14-,18?,19-,21+,22-/m1/s1 |
| SMILES |
CC(=O)OC(C[C@@]1(C)[C@H](C)CC[C@@]23COC(=O)C2=CCC[C@@H]31)c1ccoc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Tanacetum balsamita  | Ref. |
|
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