| Name |
Certonardoside D |
| Formula |
C39H66O17S |
| Mw |
838.40207141 |
| CAS RN |
476437-78-2 |
| C_ID |
C00045745
, 
|
| InChIKey |
WQQYSCDPNRQHAS-PCJSBRJRNA-N |
| InChICode |
InChI=1S/C39H66O17S/c1-18(20(3)15-52-35-33(31(26(44)17-53-35)56-57(48,49)50)55-36-32(51-6)30(46)25(43)16-54-36)7-8-19(2)21-13-23(41)34-37(21,4)12-10-27-38(5)11-9-22(40)29(45)28(38)24(42)14-39(27,34)47/h7-8,18-36,40-47H,9-17H2,1-6H3,(H,48,49,50)/b8-7+/t18-,19+,20-,21-,22+,23-,24+,25-,26+,27-,28+,29+,30+,31+,32-,33-,34-,35-,36+,37-,38-,39+/m1/s1 |
| SMILES |
CO[C@H]1[C@H](O[C@H]2[C@H](OC[C@@H](C)[C@H](C)/C=C/[C@@H](C)[C@H]3C[C@@H](O)[C@@H]4[C@]3(C)CC[C@@H]3[C@@]5(C)CC[C@H](O)[C@H](O)[C@@H]5[C@@H](O)C[C@]34O)OC[C@@H](O)[C@@H]2OS(=O)(=O)O)OC[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Certonardoa semiregularis | Ref. |
|
|
zoom in
| Organism | Certonardoa semiregularis |
|---|
| Reference | Wang,J.Nat.Prod.,65,(2002),1649 |
|---|
|
