| Name |
Enanderinanin J
(-)-Enanderinanin J |
| Formula |
C44H56O14 |
| Mw |
808.3670065 |
| CAS RN |
476677-49-3 |
| C_ID |
C00039108
, 
|
| InChIKey |
WSLVTMUJVXHIIJ-XELLHIBANA-N |
| InChICode |
InChI=1S/C44H56O14/c1-17(45)52-22-15-20-19-9-14-40(56-31(19)41-24(22)38-12-7-10-36(3,4)26(38)28(47)43(41,50)57-34(38)54-30(20)41)21-16-23(53-18(2)46)25-39-13-8-11-37(5,6)27(39)29(48)44(51)42(25,33(40)49)32(21)55-35(39)58-44/h20-30,32,34-35,47-48,50-51H,7-16H2,1-6H3/t20-,21+,22-,23-,24-,25-,26+,27+,28-,29-,30-,32-,34-,35-,38+,39+,40-,41+,42+,43+,44+/m0/s1 |
| SMILES |
[C@@H]12O[C@H]3O[C@@]4([C@H]([C@@H]5C(CCC[C@]35[C@H]3[C@]14C(=O)[C@]1([C@@H]2C[C@@H]3OC(=O)C)OC2=C([C@H]3[C@@H]4O[C@H]5O[C@@]6([C@H]([C@@H]7C(CCC[C@]57[C@@H]([C@]246)[C@H](C3)OC(=O)C)(C)C)O)O)CC1)(C)C)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Isodon xerophilus | Ref. |
|
|
zoom in
| Organism | Isodon xerophilus |
|---|
| Reference | Li,J.Nat.Prod.,70,(2007),1295 |
|---|
|
