| Name |
Ipomoeassin B
(-)-Ipomoeassin B |
| Formula |
C40H56O14 |
| Mw |
760.3670065 |
| CAS RN |
850894-52-9 |
| C_ID |
C00042622
, 
|
| InChIKey |
JMFPDJPZDSGILZ-CNTDRXMYNA-N |
| InChICode |
InChI=1S/C40H56O14/c1-5-14-28-18-13-8-7-12-17-27(41)20-22-30(42)48-23-29-35(52-31(43)21-19-26-15-10-9-11-16-26)36(53-38(47)24(3)6-2)34(46)39(51-29)54-37-33(45)32(44)25(4)49-40(37)50-28/h6,9-11,15-16,19,21,25,28-29,32-37,39-40,44-46H,5,7-8,12-14,17-18,20,22-23H2,1-4H3/b21-19+,24-6+/t25-,28+,29-,32+,33+,34-,35+,36-,37-,39+,40+/m1/s1 |
| SMILES |
C1CC(=O)CCC(=O)OC[C@H]2O[C@@H](O[C@H]3[C@H](O[C@H](CCCC1)CCC)O[C@@H]([C@@H]([C@@H]3O)O)C)[C@@H]([C@H]([C@H]2OC(=O)/C=C/c1ccccc1)OC(=O)/C(=C/C)/C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Convolvulaceae | Ipomoea squamosa | Ref. |
|
|
zoom in
| Organism | Ipomoea squamosa |
|---|
| Reference | Cao,J.Nat.Prod.,68,(2005),487 |
|---|
|
