| Name |
Nomilinic acid 4-O-beta-D-glucoside |
| Formula |
C34H46O15 |
| Mw |
694.2836708 |
| CAS RN |
113301-65-8 |
| C_ID |
C00056863
|
| InChIKey |
CPBAAJVLXNRPFA-WZKMWRJFSA-N |
| InChICode |
InChI=1S/C34H46O15/c1-15(36)45-21(12-22(38)39)32(5)18-7-9-31(4)26(16-8-10-44-14-16)47-28(43)27-34(31,48-27)33(18,6)20(37)11-19(32)30(2,3)49-29-25(42)24(41)23(40)17(13-35)46-29/h8,10,14,17-19,21,23-27,29,35,40-42H,7,9,11-13H2,1-6H3,(H,38,39)/t17-,18-,19+,21?,23-,24+,25-,26+,27-,29+,31+,32-,33+,34-/m1/s1 |
| SMILES |
CC(=O)OC(CC(=O)O)[C@]1(C)[C@H]2CC[C@@]3(C)[C@H](c4ccoc4)OC(=O)[C@H]4O[C@]43[C@]2(C)C(=O)C[C@H]1C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Citrus limon  | Ref. |
|
|
zoom in
| Organism | Citrus limon |
|---|
| Reference | Dreyer, D.L.JOC, 1965, 30, 749 (Deacetylnomilin) |
|---|
|
