| Name |
Ceparoside C |
| Formula |
C51H82O22 |
| Mw |
1046.52977431 |
| CAS RN |
1193476-53-7 |
| C_ID |
C00055362
|
| InChIKey |
IQNADYCHEXSSOU-RUYWJZBZSA-N |
| InChICode |
InChI=1S/C51H82O22/c1-20(19-66-47-42(63)40(61)37(58)31(16-52)70-47)5-8-28-21(2)34-29(68-28)14-26-24-7-6-22-13-23(9-11-50(22,3)25(24)10-12-51(26,34)4)67-49-46(69-30-15-27(55)35(56)39(60)36(30)57)44(65)45(33(18-54)72-49)73-48-43(64)41(62)38(59)32(17-53)71-48/h6,20,23-27,29-49,52-65H,5,7-19H2,1-4H3/t20-,23+,24-,25+,26+,27-,29+,30-,31-,32-,33-,34+,35+,36+,37-,38-,39-,40+,41+,42-,43-,44+,45+,46-,47-,48+,49-,50+,51+/m1/s1 |
| SMILES |
CC1=C(CC[C@@H](C)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H]2C[C@H]3[C@@H]4CC=C5C[C@@H](O[C@@H]6O[C@H](CO)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]6C[C@@H](O)[C@H](O)[C@@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Alliaceae | Allium cepa  | Ref. |
|
|
zoom in
| Organism | Allium cepa |
|---|
| Reference | Tang, S. et al., CA, 1984, 102, 218294v (Protohypoglaucine A) |
|---|
|
