| Name |
[2R-[2alpha(2R*,3R*),3alpha]]-3,4,5-Trihydroxy-benzoic acid, 2-[7-(3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl)-3,4,6-trihydroxy-5-oxo-5H-benzocyclohepten-1-yl]-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester |
| Formula |
C36H28O16 |
| Mw |
716.13773485 |
| CAS RN |
126715-85-3 |
| C_ID |
C00059533
|
| InChIKey |
XITMOAPLXFZPNE-UHFFFAOYSA-N |
| InChICode |
InChI=1S/C36H28O16/c37-13-5-20(39)18-10-25(44)34(50-26(18)7-13)16-2-1-15-17(9-24(43)32(47)29(15)33(48)30(16)45)35-28(11-19-21(40)6-14(38)8-27(19)51-35)52-36(49)12-3-22(41)31(46)23(42)4-12/h1-9,25,28,34-35,37-44,46-47H,10-11H2,(H,45,48) |
| SMILES |
O=C(OC1Cc2c(O)cc(O)cc2OC1c1cc(O)c(O)c2c(=O)c(O)c(C3Oc4cc(O)cc(O)c4CC3O)ccc12)c1cc(O)c(O)c(O)c1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Theaceae | Camellia sinensis  | Ref. |
|
|
zoom in
| Organism | Camellia sinensis |
|---|
| Reference | https://doi.org/10.1248/cpb.37.3255 |
|---|
|
