| Name |
Theaflavanoside III |
| Formula |
C33H42O19 |
| Mw |
742.23202916 |
| CAS RN |
943785-10-2 |
| C_ID |
C00058278
|
| InChIKey |
KJMFZMDPEMIHSZ-UECPNPLLSA-N |
| InChICode |
InChI=1S/C33H42O19/c1-11-22(39)26(43)29(51-31-28(45)25(42)23(40)19(9-34)49-31)32(46-11)52-30-27(44)24(41)20(10-35)50-33(30)47-14-6-15(37)21-16(38)8-17(48-18(21)7-14)12-2-4-13(36)5-3-12/h2-7,11,17,19-20,22-37,39-45H,8-10H2,1H3/t11-,17-,19+,20+,22-,23+,24+,25-,26+,27-,28+,29+,30+,31-,32-,33+/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)cc3)CC4=O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Theaceae | Camellia sinensis  | Ref. |
|
|
zoom in
| Organism | Camellia sinensis |
|---|
| Reference | Aldrich Library of FT-IR Spectra, 1st edn.,1985, 2, 94D (ir) |
|---|
|
