| Name |
Apigenin 7-rutinoside-4'-trans-caffeate |
| Formula |
C36H36O17 |
| Mw |
740.19524973 |
| CAS RN |
14637-28-6 |
| C_ID |
C00004193
, 
|
| InChIKey |
VFFCBWDFYBEZAX-MZRYECQXNA-N |
| InChICode |
InChI=1S/C36H36O17/c1-15-29(42)31(44)33(46)35(49-15)48-14-26-30(43)32(45)34(47)36(53-26)51-19-11-22(39)28-23(40)13-24(52-25(28)12-19)17-4-6-18(7-5-17)50-27(41)9-3-16-2-8-20(37)21(38)10-16/h2-13,15,26,29-39,42-47H,14H2,1H3/b9-3+/t15-,26-,29-,30+,31-,32-,33+,34+,35+,36+/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](OCC2O[C@@H](Oc3cc(O)c4c(=O)cc(-c5ccc(OC(=O)/C=C/c6ccc(O)c(O)c6)cc5)oc4c3)C(O)[C@@H](O)[C@@H]2O)C(O)C(O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Mentha piperita  | Ref. |
|
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