| Name |
Agastenol
(+)-Agastenol |
| Formula |
C27H26O8 |
| Mw |
478.16276781 |
| CAS RN |
413615-34-6 |
| C_ID |
C00045218
, 
|
| InChIKey |
NYOJCGUMMQIVQV-FMNNFJNGNA-N |
| InChICode |
InChI=1S/C27H26O8/c1-32-24-12-16(3-9-22(24)29)11-19-14-34-26(18-6-10-23(30)25(13-18)33-2)21(19)15-35-27(31)17-4-7-20(28)8-5-17/h3-13,21,26,28-30H,14-15H2,1-2H3/b19-11-/t21-,26+/m1/s1 |
| SMILES |
c1(ccc(cc1)C(=O)OC[C@@H]1/C(=C\c2cc(c(cc2)O)OC)/CO[C@H]1c1cc(c(cc1)O)OC)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Agastache rugosa  | Ref. |
|
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