| Name |
Capsianoside XVIII |
| Formula |
C56H94O31 |
| Mw |
1262.57790629 |
| CAS RN |
1190371-31-3 |
| C_ID |
C00054845
|
| InChIKey |
CSRJQBLJLKTXGK-HYYQJQGSSA-N |
| InChICode |
InChI=1S/C56H94O31/c1-7-56(6,87-55-47(75)42(70)49(30(20-60)83-55)85-54-45(73)39(67)35(63)29(19-59)82-54)16-10-15-27(17-57)14-9-12-23(2)11-8-13-24(3)76-21-31-36(64)40(68)50(32(80-31)22-77-51-43(71)37(65)33(61)25(4)78-51)86-52-46(74)41(69)48(26(5)79-52)84-53-44(72)38(66)34(62)28(18-58)81-53/h7,12-13,15,25-26,28-55,57-75H,1,8-11,14,16-22H2,2-6H3/b23-12+,24-13-,27-15-/t25-,26-,28+,29+,30+,31-,32+,33-,34+,35+,36-,37+,38-,39-,40+,41-,42+,43+,44+,45+,46+,47+,48-,49+,50+,51+,52-,53-,54-,55-,56+/m0/s1 |
| SMILES |
O[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@@](C=C)(C)CC/C=C(CO)/CC/C=C(C)/CC/C=C(OC[C@@H]3O[C@H](CO[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)[C@@H](O[C@H]5[C@H](O)[C@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O6)[C@H](C)O5)[C@H](O)[C@H]3O)/C)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Solanaceae | Capsicum chinense  | Ref. |
|
|
zoom in
| Organism | Capsicum chinense |
|---|
| Reference | Lee, J.-H. et al., Chem. Pharm. Bull., 2009, 57, 730-733 (Capsianoside XVIII) |
|---|
|
