| Name |
Pedunculol |
| Formula |
C38H52O6 |
| Mw |
604.37638939 |
| CAS RN |
122537-45-5 |
| C_ID |
C00056068
|
| InChIKey |
FUKBDBWLYOKMMP-LPEHXNHASA-N |
| InChICode |
InChI=1S/C38H52O6/c1-22(2)11-13-27(25(7)8)20-37-21-28(15-12-23(3)4)36(9,10)38(35(37)44,18-17-24(5)6)34(43)31(33(37)42)32(41)26-14-16-29(39)30(40)19-26/h11-12,14,16-17,19,25,27-28,39-40,42H,13,15,18,20-21H2,1-10H3/t27-,28-,37-,38+/m1/s1 |
| SMILES |
OC1=C(C([C@@](C/C=C(C)C)(C2=O)C(C)(C)[C@H](C/C=C(C)C)C[C@]12C[C@@H](C/C=C(C)C)C(C)C)=O)C(C3=CC(O)=C(O)C=C3)=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Clusiaceae/Clusiaceae-Guttiferae | Garcinia pedunculata  | Ref. |
|
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