| Name |
Premnaodoroside E
(-)-Premnaodoroside E |
| Formula |
C42H62O20 |
| Mw |
886.38344442 |
| CAS RN |
260803-63-2 |
| C_ID |
C00040066
, 
|
| InChIKey |
JXGWKVGGSXIIQW-ZMRNRJLVNA-N |
| InChICode |
InChI=1S/C42H62O20/c1-17(13-55-37(53)23-15-57-39(29-19(3)25(45)9-21(23)29)61-41-35(51)33(49)31(47)27(11-43)59-41)7-5-6-8-18(2)14-56-38(54)24-16-58-40(30-20(4)26(46)10-22(24)30)62-42-36(52)34(50)32(48)28(12-44)60-42/h15-18,21-22,25-36,39-52H,3-14H2,1-2H3/t17-,18-,21+,22+,25-,26-,27+,28+,29+,30+,31+,32+,33-,34-,35+,36+,39-,40-,41-,42-/m0/s1 |
| SMILES |
C=C1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)OCC(C)CCCCC(C)COC(=O)C3=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]4C(=C)[C@@H](O)C[C@H]34)[C@H]2C[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Premna subscandens | Ref. |
|
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