| Name |
Javanicoside F |
| Formula |
C33H44O16 |
| Mw |
696.26293536 |
| CAS RN |
713503-96-9 |
| C_ID |
C00051034
|
| InChIKey |
SVLMUIWHTIHSPF-MBVOFBEWNA-N |
| InChICode |
InChI=1S/C33H44O16/c1-6-12(2)7-18(35)49-24-26-32-11-45-33(26,30(43)44-5)27(41)23(40)25(32)31(4)9-15(19(36)13(3)14(31)8-17(32)48-28(24)42)46-29-22(39)21(38)20(37)16(10-34)47-29/h7,9,13-14,16-17,20-27,29,34,37-41H,6,8,10-11H2,1-5H3/b12-7+/t13-,14-,16+,17+,20+,21-,22+,23+,24+,25+,26+,27-,29+,31-,32+,33-/m0/s1 |
| SMILES |
CC/C(C)=C/C(=O)O[C@H]1C(=O)O[C@@H]2C[C@H]3[C@H](C)C(=O)C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=C[C@]3(C)[C@H]3[C@@H](O)[C@H](O)[C@@]4(C(=O)OC)OC[C@]32[C@@H]14 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Simaroubaceae | Brucea javanica  | Ref. |
|
|
zoom in
| Organism | Brucea javanica |
|---|
| Reference | Kim, et al., Journal of Natural Products, 67, (2004), 863 |
|---|
|
