| Name |
Theaflagallin |
| Formula |
C20H16O9 |
| Mw |
400.07943211 |
| CAS RN |
102208-15-1 |
| C_ID |
C00009352
, 
|
| InChIKey |
KOXRJHMEFYNYME-CDESSEEXNA-N |
| InChICode |
InChI=1S/C20H16O9/c21-9-4-11(22)10-6-14(25)20(29-15(10)5-9)8-1-7-2-13(24)18(27)19(28)16(7)17(26)12(23)3-8/h1-5,14,20-22,24-25,27-28H,6H2,(H,23,26)/t14-,20+/m0/s1 |
| SMILES |
O=c1c(O)cc([C@H]2Oc3cc(O)cc(O)c3C[C@@H]2O)cc2cc(O)c(O)c(O)c12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Theaceae | Camellia sinensis var. assamica  | Ref. |
|
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