| Name |
Smilaside I
(+)-Smilaside I |
| Formula |
C42H44O19 |
| Mw |
852.24767923 |
| CAS RN |
1023755-01-2 |
| C_ID |
C00034261
, 
|
| InChIKey |
YWTCWUMCRKCKAD-WWHVMFIUNA-N |
| InChICode |
InChI=1S/C42H44O19/c1-23(43)55-20-31-36(50)37(51)38(52)41(58-31)61-42(22-57-34(48)16-8-24-3-11-27(44)12-4-24)40(53)39(59-35(49)18-9-25-5-13-28(45)14-6-25)32(60-42)21-56-33(47)17-10-26-7-15-29(46)30(19-26)54-2/h3-19,31-32,36-41,44-46,50-53H,20-22H2,1-2H3/b16-8+,17-10+,18-9+/t31-,32-,36-,37+,38-,39-,40+,41-,42+/m1/s1 |
| SMILES |
[C@H]1([C@H]([C@@H]([C@@](O1)(O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O)O)O)COC(=O)/C=C/c1ccc(cc1)O)O)OC(=O)/C=C/c1ccc(cc1)O)COC(=O)/C=C/c1ccc(c(c1)OC)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Smilacaceae | Smilax bracteata | Ref. |
|
|
zoom in
| Organism | Smilax bracteata |
|---|
| Reference | Zhang,Phytochem.,69,(2008),1398 |
|---|
|
