| Name |
Bruguierin A
(+)-Bruguierin A |
| Formula |
C48H86O4 |
| Mw |
726.65261123 |
| CAS RN |
880162-08-3 |
| C_ID |
C00041401
, 
|
| InChIKey |
BCRQTNOYBAWCDF-RDNFHBRHNA-N |
| InChICode |
InChI=1S/C48H86O4/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-43(50)52-42-35-41(49)48(9)39(44(42,4)5)31-34-46(7)40(48)29-28-37-38(30-33-45(37,46)6)47(8,51)32-25-26-36(2)3/h26,37-42,49,51H,10-25,27-35H2,1-9H3/t37-,38+,39+,40+,41-,42+,45-,46-,47+,48+/m1/s1 |
| SMILES |
CCCCCCCCCCCCCCCCCC(=O)O[C@H]1C[C@@H](O)[C@]2(C)[C@H]3CC[C@@H]4[C@@H]([C@@](C)(O)CCC=C(C)C)CC[C@@]4(C)[C@]3(C)CC[C@H]2C1(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rhizophoraceae | Bruguiera gymmorrhiza | Ref. |
|
|
zoom in
| Organism | Bruguiera gymmorrhiza |
|---|
| Reference | Homhual,J.Nat.Prod.,69,(2006),421 |
|---|
|
