| Name |
(1E)-1,4-Deepoxy-1,2-didehydro-19-deoxy-O17-beta-D-glucopyranosyl-4-hydroxy-limonoic acid
trans-Obacunoic acid 17-glucoside |
| Formula |
C32H44O14 |
| Mw |
652.27310612 |
| CAS RN |
127644-15-9 |
| C_ID |
C00057006
|
| InChIKey |
OXLUYYPDQWGUIX-VQHVLOKHSA-N |
| InChICode |
InChI=1S/C32H44O14/c1-28(2,42)18-12-19(34)31(5)17(29(18,3)9-7-20(35)36)6-10-30(4,32(31)25(46-32)26(40)41)24(15-8-11-43-14-15)45-27-23(39)22(38)21(37)16(13-33)44-27/h7-9,11,14,16-18,21-25,27,33,37-39,42H,6,10,12-13H2,1-5H3,(H,35,36)(H,40,41)/b9-7+ |
| SMILES |
CC(C)(O)C1CC(=O)C2(C)C(CCC(C)(C(OC3OC(CO)C(O)C(O)C3O)c3ccoc3)C23OC3C(=O)O)C1(C)/C=C/C(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Citrus paradisi  | Ref. |
| Plantae | Rutaceae | Citrus paradisii | Ref. |
|
|
zoom in
| Organism | Citrus paradisi |
|---|
| Reference | https://doi.org/10.1016/S0031-9422(00)98087-7 |
|---|
|
