| Name |
Sphaerobioside heptaacetate |
| Formula |
C41H44O21 |
| Mw |
872.23750847 |
| CAS RN |
869592-78-9 |
| C_ID |
C00058236
|
| InChIKey |
YZCUKNHEZJTCLY-VFERETTOSA-N |
| InChICode |
InChI=1S/C41H44O21/c1-17-34(55-19(3)43)36(57-21(5)45)38(59-23(7)47)40(53-17)52-16-31-35(56-20(4)44)37(58-22(6)46)39(60-24(8)48)41(62-31)61-27-13-29(49)32-30(14-27)51-15-28(33(32)50)25-9-11-26(12-10-25)54-18(2)42/h9-15,17,31,34-41,49H,16H2,1-8H3/t17-,31+,34-,35+,36+,37-,38+,39+,40+,41+/m0/s1 |
| SMILES |
CC(=O)Oc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]5OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)cc(O)c3c2=O)cc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Clusiaceae/Clusiaceae-Guttiferae | Garcinia dulcis  | Ref. |
|
|
zoom in
| Organism | Garcinia dulcis |
|---|
| Reference | Bognar, R. et al., Chem. Ind. (London), 1954, 518 (Sophoricoside, synth) |
|---|
|
