| Name |
beta-Chacotriosyllilagen |
| Formula |
C45H72O17 |
| Mw |
884.47695088 |
| CAS RN |
265092-97-5 |
| C_ID |
C00054919
|
| InChIKey |
KDRHBRBDBYKMFS-CTECBPJXSA-N |
| InChICode |
InChI=1S/C45H72O17/c1-18-9-12-45(55-17-18)19(2)30-28(62-45)14-25-23-8-7-22-13-27(26(47)15-44(22,6)24(23)10-11-43(25,30)5)58-42-39(61-41-36(53)34(51)32(49)21(4)57-41)37(54)38(29(16-46)59-42)60-40-35(52)33(50)31(48)20(3)56-40/h7,18-21,23-42,46-54H,8-17H2,1-6H3/t18-,19-,20-,21-,23+,24-,25-,26+,27+,28-,29+,30-,31-,32-,33+,34+,35+,36+,37-,38+,39+,40-,41-,42+,43-,44-,45+/m0/s1 |
| SMILES |
OC[C@H]1O[C@@H](O[C@@H]2CC([C@]3(C)C[C@H]2O)=CC[C@@]4([C@@]3(CC[C@@]5(C)[C@]4(C[C@]6([C@@]5([C@H](C)[C@]7(OC[C@@H](C)CC7)O6)[H])[H])[H])[H])[H])[C@@H]([C@H]([C@@H]1O[C@@H]8O[C@H]([C@@H]([C@H]([C@H]8O)O)O)C)O)O[C@H]9[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O9 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Alliaceae | Allium tuberosum  | Ref. |
|
|
zoom in
| Organism | Allium tuberosum |
|---|
| Reference | Marker, R.E. et al., JACS, 1940, 62, 2620
1947, 69, 2167
1947, 69, 2373
2389
24 (Yuccagenin) |
|---|
|
