| Name |
Ajugin E
(+)-Ajugin E |
| Formula |
C28H38O7 |
| Mw |
486.26175357 |
| CAS RN |
261705-98-0 |
| C_ID |
C00038395
, 
|
| InChIKey |
BAIDVXUGHJDBOO-ZZKUPKNNNA-N |
| InChICode |
InChI=1S/C28H38O7/c1-16-14-22(35-23(31)18(16)15-29)26(4,32)28(34)13-12-27(33)20-9-8-17-6-5-7-21(30)25(17,3)19(20)10-11-24(27,28)2/h5-6,8,19-20,22,29,32-34H,7,9-15H2,1-4H3/t19-,20+,22+,24-,25-,26-,27+,28-/m0/s1 |
| SMILES |
CC1=C(CO)C(=O)O[C@@H]([C@](C)(O)[C@]2(O)CC[C@@]3(O)[C@@H]4CC=C5C=CCC(=O)[C@]5(C)[C@H]4CC[C@]23C)C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Ajuga parviflora | Ref. |
|
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