| Name |
Aquilegioside A |
| Formula |
C47H74O19 |
| Mw |
942.48243018 |
| CAS RN |
235777-17-0 |
| C_ID |
C00029705
, 
|
| InChIKey |
YUCORSXPQUBWMI-XYPOXIHRNA-N |
| InChICode |
InChI=1S/C47H74O19/c1-20-6-7-24(62-39(20)59)21(2)30-22(50)14-45(5)28-9-8-27-43(3,19-49)29(10-11-46(27)18-47(28,46)13-12-44(30,45)4)65-42-38(31(52)23(51)16-60-42)66-41-37(58)35(56)33(54)26(64-41)17-61-40-36(57)34(55)32(53)25(15-48)63-40/h6,21-38,40-42,48-58H,7-19H2,1-5H3/t21-,22-,23+,24+,25-,26-,27+,28+,29+,30+,31+,32-,33-,34+,35+,36-,37-,38-,40-,41-,42+,43+,44-,45+,46-,47+/m1/s1 |
| SMILES |
CC1=CC[C@@H]([C@@H](C)[C@H]2[C@H](O)C[C@@]3(C)[C@@H]4CC[C@H]5[C@](C)(CO)[C@@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6OC6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]56C[C@@]46CC[C@]23C)OC1=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Ranunculaceae | Aquilegia flabellate SIEB.et ZUCC.var.flabellata | Ref. |
| Plantae | Ranunculaceae | Aquilegia vulgaris  | Ref. |
|
|
zoom in
| Organism | Aquilegia flabellate SIEB.et ZUCC.var.flabellata |
|---|
| Reference | Yoshimitsu,Phytochem.,51,(1999),449 |
|---|
|
