| Name |
Okanin 4'-O-(2''-O-caffeoyl-6''-O-acetylglucoside)
3,4,2',3',4'-Pentahydroxychalcone 4'-O-(2''-O-caffeoyl-6''-O-acetylglucoside) |
| Formula |
C32H30O15 |
| Mw |
654.15847029 |
| CAS RN |
142628-30-6 |
| C_ID |
C00014510
, 
|
| InChIKey |
IBRTYDZLUQXQRB-ROEIYUKKNA-N |
| InChICode |
InChI=1S/C32H30O15/c1-15(33)44-14-25-29(42)30(43)31(47-26(39)11-5-17-4-9-21(36)23(38)13-17)32(46-25)45-24-10-6-18(27(40)28(24)41)19(34)7-2-16-3-8-20(35)22(37)12-16/h2-13,25,29-32,35-38,40-43H,14H2,1H3/b7-2+,11-5+/t25-,29-,30+,31-,32-/m1/s1 |
| SMILES |
c1(c(c(c(cc1)C(=O)/C=C/c1ccc(c(c1)O)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O)O)OC(=O)/C=C/c1cc(c(cc1)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Bidens frondosa  | Ref. |
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