| Name |
6-O-(E)-Caffeoyl-1,3,4-tri-O-galloyl-beta-D-glucopyranose |
| Formula |
C36H30O21 |
| Mw |
798.12795803 |
| CAS RN |
359819-48-0 |
| C_ID |
C00032670
, 
|
| InChIKey |
FUVDIBXEXWCWKY-MEIOXNSUNA-N |
| InChICode |
InChI=1S/C36H30O21/c37-17-3-1-13(5-18(17)38)2-4-26(45)53-12-25-31(55-33(50)14-6-19(39)27(46)20(40)7-14)32(56-34(51)15-8-21(41)28(47)22(42)9-15)30(49)36(54-25)57-35(52)16-10-23(43)29(48)24(44)11-16/h1-11,25,30-32,36-44,46-49H,12H2/b4-2+/t25-,30-,31-,32-,36+/m1/s1 |
| SMILES |
[C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1COC(=O)/C=C\c1ccc(c(c1)O)O)OC(=O)c1cc(c(c(c1)O)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Balanophoraceae | Balanophora japonica | Ref. |
|
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