| Name |
Bryoferulic acid |
| Formula |
C40H54O6 |
| Mw |
630.39203946 |
| CAS RN |
441018-41-3 |
| C_ID |
C00054615
|
| InChIKey |
MKXOPSSUNSEZJV-COSPWPRJSA-N |
| InChICode |
InChI=1S/C40H54O6/c1-35(2)30-13-11-27-26(15-18-40(7)31-24-37(4,34(43)44)20-19-36(31,3)21-22-39(27,40)6)38(30,5)17-16-32(35)46-33(42)14-10-25-9-12-28(41)29(23-25)45-8/h9-12,14-15,23,30-32,41H,13,16-22,24H2,1-8H3,(H,43,44)/b14-10+/t30-,31+,32-,36+,37+,38+,39+,40-/m0/s1 |
| SMILES |
COc1cc(/C=C/C(=O)O[C@H]2CC[C@]3(C)C4=CC[C@@]5(C)[C@@H]6C[C@](C)(C(=O)O)CC[C@]6(C)CC[C@]5(C)C4=CC[C@H]3C2(C)C)ccc1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Fungi | Glomeraceae | Glomus caledonium | Ref. |
|
|
zoom in
| Organism | Glomus caledonium |
|---|
| Reference | Hylands, P.J. et al., Phytochemistry, 1979, 18, 1843-1845 (3alpha-form, Bryonia dioica constit) |
|---|
|
